4-[(4-ethylphenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(4-ethylphenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide Openeye Name: 4-[(4-ethylphenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide CAS Name: 4-[(4-ethylphenyl)methyl-methylamino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(4-ethylphenyl)methyl-methylamino]-3-nitrobenzenesulfonamide Traditional Name: 4-[(4-ethylbenzyl)-methyl-amino]-3-nitro-benzenesulfonamide Formula: C16H19N3O4S MolecularWeight: 349.40476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C)C2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C)C2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O4S/c1-3-12-4-6-13(7-5-12)11-18(2)15-9-8-14(24(17,22)23)10-16(15)19(20)21/h4-10H,3,11H2,1-2H3,(H2,17,22,23)