[4-[3-(methylamino)-4-nitro-phenyl]piperazin-1-yl]-(2-methylphenyl)methanone

Systemtic Name: [4-[3-(methylamino)-4-nitro-phenyl]piperazin-1-yl]-(2-methylphenyl)methanone Openeye Name: [4-[3-(methylamino)-4-nitro-phenyl]piperazin-1-yl]-(o-tolyl)methanone CAS Name: [4-[3-(methylamino)-4-nitrophenyl]-1-piperazinyl]-(2-methylphenyl)methanone IUPAC Name: [4-[3-(methylamino)-4-nitrophenyl]piperazin-1-yl]-(2-methylphenyl)methanone Traditional Name: [4-[3-(methylamino)-4-nitro-phenyl]piperazino]-(o-tolyl)methanone Formula: C19H22N4O3 MolecularWeight: 354.40298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NC

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NC

InChI

InChI=1S/C19H22N4O3/c1-14-5-3-4-6-16(14)19(24)22-11-9-21(10-12-22)15-7-8-18(23(25)26)17(13-15)20-2/h3-8,13,20H,9-12H2,1-2H3