Compound Identification
SMILES
[Cl-].C[C@@H](O)[C@@H]1[C@H]2[C@@H](C)C(CN3CC4=CC=CC5=C(CC[N+]67CC[N+](CC(N)=O)(CC6)CC7)C=CC(=C45)S3(=O)=O)=C(N2C1=O)C([O-])=O
InChIKey
InChIKey=ZGBQMHHTBVVIKO-VZUCKBNASA-N
Formula
C32H40ClN5O7S
Mass
674.21
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalene sulfonic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
1-naphthalene sulfonic acids and derivatives
Alternative Parents
1-naphthalene sulfonamides Alpha amino acid amides Carbapenems N-piperazineacetamides Benzothiazines Phenethylamines Pyrroline carboxylic acids Aralkylamines Azepines N-alkylpiperazines 1,2-thiazines Organosulfonamides Tetraalkylammonium salts Tertiary carboxylic acid amides Secondary alcohols Primary carboxylic acid amides Azetidines Carboxylic acid salts Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Organic zwitterions Organic chloride salts Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonamide - Naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - Alpha-amino acid amide - Carbapenem - Benzothiazine - N-piperazineacetamide - Alpha-amino acid or derivatives - Phenethylamine - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Aralkylamine - N-alkylpiperazine - Azepine - 1,4-diazinane - Piperazine - Ortho-thiazine - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Quaternary ammonium salt - Pyrroline - Tertiary carboxylic acid amide - Beta-lactam - Tetraalkylammonium salt - Azetidine - Carboxamide group - Carboxylic acid salt - Lactam - Secondary alcohol - Primary carboxylic acid amide - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid - Organoheterocyclic compound - Carboxylic acid derivative - Amine - Alcohol - Carbonyl group - Organic oxygen compound - Organic chloride salt - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-naphthalene sulfonic acids and derivatives. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group (or a derivative thereof) at the 1-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available