(3,4-dimethylphenyl)-[4-[3-(methylamino)-4-nitro-phenyl]piperazin-1-yl]methanone

Systemtic Name: (3,4-dimethylphenyl)-[4-[3-(methylamino)-4-nitro-phenyl]piperazin-1-yl]methanone Openeye Name: (3,4-dimethylphenyl)-[4-[3-(methylamino)-4-nitro-phenyl]piperazin-1-yl]methanone CAS Name: (3,4-dimethylphenyl)-[4-[3-(methylamino)-4-nitrophenyl]-1-piperazinyl]methanone IUPAC Name: (3,4-dimethylphenyl)-[4-[3-(methylamino)-4-nitrophenyl]piperazin-1-yl]methanone Traditional Name: (3,4-dimethylphenyl)-[4-[3-(methylamino)-4-nitro-phenyl]piperazino]methanone Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NC)C

InChI

InChI=1S/C20H24N4O3/c1-14-4-5-16(12-15(14)2)20(25)23-10-8-22(9-11-23)17-6-7-19(24(26)27)18(13-17)21-3/h4-7,12-13,21H,8-11H2,1-3H3