[4-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methylamino]-3-nitro-phenyl]-phenyl-methanone

Systemtic Name: [4-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methylamino]-3-nitro-phenyl]-phenyl-methanone Openeye Name: [4-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]methylamino]-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]methylamino]-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methylamino]-3-nitrophenyl]-phenylmethanone Traditional Name: [4-[[6-(4-methylpiperazino)-3-pyridyl]methylamino]-3-nitro-phenyl]-phenyl-methanone Formula: C24H25N5O3 MolecularWeight: 431.487

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C=C2)CNC3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C=C2)CNC3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H25N5O3/c1-27-11-13-28(14-12-27)23-10-7-18(17-26-23)16-25-21-9-8-20(15-22(21)29(31)32)24(30)19-5-3-2-4-6-19/h2-10,15,17,25H,11-14,16H2,1H3