N-(2-dimethylaminoethyl)-4-[(2-methylphenyl)methylamino]-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-[(2-methylphenyl)methylamino]-3-nitro-benzenesulfonamide Openeye Name: N-(2-dimethylaminoethyl)-3-nitro-4-(o-tolylmethylamino)benzenesulfonamide CAS Name: N-(2-dimethylaminoethyl)-4-[(2-methylphenyl)methylamino]-3-nitrobenzenesulfonamide IUPAC Name: N-(2-dimethylaminoethyl)-4-[(2-methylphenyl)methylamino]-3-nitrobenzenesulfonamide Traditional Name: N-(2-dimethylaminoethyl)-4-[(2-methylbenzyl)amino]-3-nitro-benzenesulfonamide Formula: C18H24N4O4S MolecularWeight: 392.47256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC2=C(C=C(C=C2)S(=O)(=O)NCCN(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CNC2=C(C=C(C=C2)S(=O)(=O)NCCN(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H24N4O4S/c1-14-6-4-5-7-15(14)13-19-17-9-8-16(12-18(17)22(23)24)27(25,26)20-10-11-21(2)3/h4-9,12,19-20H,10-11,13H2,1-3H3