[4-(diphenylmethyl)piperazin-1-yl]-[2-(methylamino)-5-nitro-phenyl]methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-1-yl]-[2-(methylamino)-5-nitro-phenyl]methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-[2-(methylamino)-5-nitro-phenyl]methanone CAS Name: [4-(diphenylmethyl)-1-piperazinyl]-[2-(methylamino)-5-nitrophenyl]methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-[2-(methylamino)-5-nitrophenyl]methanone Traditional Name: (4-benzhydrylpiperazino)-[2-(methylamino)-5-nitro-phenyl]methanone Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N4O3/c1-26-23-13-12-21(29(31)32)18-22(23)25(30)28-16-14-27(15-17-28)24(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-13,18,24,26H,14-17H2,1H3