Compound Identification
SMILES
COC1=CC=C(CNC2=C(C=C(C=C2)S(=O)(=O)N2CCCC2)[N+]([O-])=O)C=C1
InChIKey
InChIKey=ICQRAVDPLCONQS-UHFFFAOYSA-N
Formula
C18H21N3O5S
Mass
391.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Phenylmethylamines
- Level 5 Phenylbenzamines
-
Subclass
Phenylmethylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbenzamines
Alternative Parents
Aminobenzenesulfonamides Benzenesulfonyl compounds Nitrobenzenes Aniline and substituted anilines Anisoles Benzylamines Methoxybenzenes Nitroaromatic compounds Phenoxy compounds Phenylalkylamines Secondary alkylarylamines Alkyl aryl ethers Organosulfonamides Pyrrolidines Sulfonyls Azacyclic compounds Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbenzamine - Aminobenzenesulfonamide - Benzenesulfonamide - Nitrobenzene - Benzenesulfonyl group - Phenol ether - Aniline or substituted anilines - Phenylalkylamine - Methoxybenzene - Anisole - Nitroaromatic compound - Phenoxy compound - Benzylamine - Secondary aliphatic/aromatic amine - Aralkylamine - Alkyl aryl ether - Organosulfonic acid amide - Pyrrolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Azacycle - Ether - Organoheterocyclic compound - Organic oxoazanium - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic zwitterion - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
External Descriptors
Not available