Compound Identification
SMILES
COOOSC1=CC=CC(=C1)N=NC1=CC(OC)=C(NC2=NC(NCCO)=NC(NC3=CC4=C(C=C(C)C=C4C=C3)S(=O)(=O)OC)=N2)C=C1
InChIKey
InChIKey=ZRKZGELAZWFYAI-UHFFFAOYSA-N
Formula
C31H32N8O8S2
Mass
708.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
-
Class
Naphthalenes
-
Subclass
Naphthalene sulfonic acids and derivatives
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Level 5
Naphthalene sulfonates
- Level 6 1-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
1-naphthalene sulfonates
Alternative Parents
1-naphthalene sulfonic acids and derivatives Azobenzenes Arylsulfonic acids and derivatives Methoxyanilines Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers N-aliphatic s-triazines 1,3,5-triazines Organosulfonic acid esters Heteroaromatic compounds Sulfonyls Azo compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Alkanolamines Primary alcohols Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Azobenzene - 1-naphthalene sulfonic acid or derivatives - 1-naphthalene sulfonate - Arylsulfonic acid or derivatives - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Aniline or substituted anilines - Alkyl aryl ether - Amino-1,3,5-triazine - Aminotriazine - N-aliphatic s-triazine - Monocyclic benzene moiety - Organosulfonic acid ester - Triazine - 1,3,5-triazine - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Azo compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Alkanolamine - Organoheterocyclic compound - Azacycle - Sulfenyl compound - Ether - Amine - Alcohol - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Primary alcohol - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available