N-methyl-4-[2-(2-methylphenyl)ethylamino]-3-nitro-benzenesulfonamide

Systemtic Name: N-methyl-4-[2-(2-methylphenyl)ethylamino]-3-nitro-benzenesulfonamide Openeye Name: N-methyl-3-nitro-4-[2-(o-tolyl)ethylamino]benzenesulfonamide CAS Name: N-methyl-4-[2-(2-methylphenyl)ethylamino]-3-nitrobenzenesulfonamide IUPAC Name: N-methyl-4-[2-(2-methylphenyl)ethylamino]-3-nitrobenzenesulfonamide Traditional Name: N-methyl-3-nitro-4-[2-(o-tolyl)ethylamino]benzenesulfonamide Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCNC2=C(C=C(C=C2)S(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CCNC2=C(C=C(C=C2)S(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O4S/c1-12-5-3-4-6-13(12)9-10-18-15-8-7-14(24(22,23)17-2)11-16(15)19(20)21/h3-8,11,17-18H,9-10H2,1-2H3