Compound Identification
SMILES
CC(O)=O.C[N+]1=CN(CCC(=O)NC2=CC=C(C=C2)N=NC2=C(C=C3C=C(NC(=O)CC[N+]4=CC=CC(=C4)C(N)=O)C=CC3=C2[O-])S([O-])(=O)=O)C=C1
InChIKey
InChIKey=VTOFUHMIAHGBQT-UHFFFAOYSA-N
Formula
C34H34N8O9S
Mass
730.75
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
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 1-sulfo,2-unsubstituted aromatic compounds Anilides Nicotinamides N-arylamides Phenoxides Pyridinium derivatives N-substituted imidazoles Vinylogous amides Sulfonyls Organosulfonic acids Heteroaromatic compounds Secondary carboxylic acid amides Primary carboxylic acid amides Azo compounds Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic zwitterions Carbonyl compounds Organic salts Organic oxides
Molecular Framework
Not available
Substituents
2-naphthalene sulfonic acid or derivatives - 2-naphthalene sulfonate - Arylsulfonic acid or derivatives - Pyridine carboxylic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Anilide - Nicotinamide - N-arylamide - Phenoxide - Pyridine - Monocyclic benzene moiety - Pyridinium - N-substituted imidazole - Azole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Vinylogous amide - Imidazole - Sulfonyl - Organosulfonic acid - Carboxamide group - Azo compound - Secondary carboxylic acid amide - Primary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic salt - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic zwitterion - Aromatic heteropolycyclic 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