Compound Identification
SMILES
CCOC1=CC(NN=C2C(=O)C3=C(C=C(C(=NNC4=CC(C(O)=O)=C(C=C4)[N+]([O-])=O)C3=O)S(O)(=O)=O)C=C2S(O)(=O)=O)=C(OCC)C=C1N=NC1=C(C=C(N)C=C1)S(O)(=O)=O
InChIKey
InChIKey=NSASALMKLKKHTF-UHFFFAOYSA-N
Formula
C33H28N8O17S3
Mass
904.81
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Naphthalenes
-
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
-
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 Azobenzenes Nitrobenzoic acids and derivatives Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Benzoic acids Nitrobenzenes Aniline and substituted anilines Phenylhydrazines Phenoxy compounds Phenol ethers Benzoyl derivatives Nitroaromatic compounds Alkyl aryl ethers Sulfonyls Organosulfonic acids Amino acids Azo compounds Hydrazones Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Primary amines Organic salts Organic oxides Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Azobenzene - 2-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - Nitrobenzoate - Benzenesulfonate - 1-sulfo,2-unsubstituted aromatic compound - Arylsulfonic acid or derivatives - Benzoic acid - Benzoic acid or derivatives - Nitrobenzene - Benzenesulfonyl group - Nitroaromatic compound - Phenoxy compound - Aniline or substituted anilines - Phenylhydrazine - Phenol ether - Benzoyl - Alkyl aryl ether - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Amino acid or derivatives - Amino acid - Azo compound - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Hydrazone - Organic oxoazanium - Organic oxide - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic salt - Primary amine - Organosulfur compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic cation - 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