Compound Identification
SMILES
CC(=O)N1CCN(CC1)C(=O)[C@H](CCCN=C(N)N[N+]([O-])=O)NS(=O)(=O)C1=CC=CC2=CC=CC=C12
InChIKey
InChIKey=IOGYJRIZCICVPC-IBGZPJMESA-N
Formula
C22H29N7O6S
Mass
519.58
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 Nitroguanidines Piperazines Organosulfonamides Tertiary carboxylic acid amides Acetamides Aminosulfonyl compounds Nitramines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboximidamides Organic zwitterions Organic oxides Carbonyl compounds Organic salts Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-naphthalene sulfonamide - 1-naphthalene sulfonic acid or derivatives - Naphthalene sulfonamide - Alpha-amino acid amide - Alpha-amino acid or derivatives - Nitroguanidine - Piperazine - Organosulfonic acid amide - 1,4-diazinane - Nitramine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Acetamide - Sulfonyl - Tertiary carboxylic acid amide - Aminosulfonyl compound - Carboxamide group - Organic nitro compound - Guanidine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Carboximidamide - Azacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen 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