Compound Identification
SMILES
COC1=CC(N\N=C2/C(=O)C=C(C3=C2C=CC(NC(=O)C2=CC=C(N)C=C2)=C3)S(O)(=O)=O)=C(OC)C=C1N=NC1=C2C=C(C=CC2=C(C=C1)N=NC1=CC(=CC=C1)S(O)(=O)=O)S(O)(=O)=O
InChIKey
InChIKey=ZNQGHLKHQGOPIO-BVWNZJCASA-N
Formula
C41H32N8O13S3
Mass
940.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Naphthalenes
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Subclass
Naphthalene sulfonic acids and derivatives
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Level 5
Naphthalene sulfonates
- Level 6 2-naphthalene sulfonates
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Level 5
Naphthalene sulfonates
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Subclass
Naphthalene sulfonic acids and derivatives
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalene sulfonic acids and derivatives
Intermediate Tree Nodes
Naphthalene sulfonates
Direct Parent
2-naphthalene sulfonates
Alternative Parents
2-naphthalene sulfonic acids and derivatives Aminobenzoic acids and derivatives Benzenesulfonic acids and derivatives Dimethoxybenzenes 1-sulfo,2-unsubstituted aromatic compounds Benzamides Benzenesulfonyl compounds Methoxyanilines Anisoles Phenylhydrazines Phenoxy compounds Benzoyl derivatives Alkyl aryl ethers Sulfonyls Organosulfonic acids Cyclic ketones Amino acids and derivatives Secondary carboxylic acid amides Azo compounds Propargyl-type 1,3-dipolar organic compounds Hydrazones Primary amines Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
2-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - Benzenesulfonate - Aminobenzoic acid or derivatives - Dimethoxybenzene - P-dimethoxybenzene - Benzoic acid or derivatives - Benzamide - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Methoxyaniline - Benzenesulfonyl group - Methoxybenzene - Anisole - Phenoxy compound - Phenol ether - Benzoyl - Aniline or substituted anilines - Phenylhydrazine - Alkyl aryl ether - Monocyclic benzene moiety - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Secondary carboxylic acid amide - Ketone - Carboxamide group - Azo compound - Cyclic ketone - Amino acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrazone - Carboxylic acid derivative - Ether - Organooxygen compound - Organosulfur compound - Primary amine - Amine - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available