[4-(methylamino)-3-nitro-phenyl]-[2-(4-piperidin-1-ylcarbonylpiperazin-1-yl)carbonylphenyl]methanone

Systemtic Name: [4-(methylamino)-3-nitro-phenyl]-[2-(4-piperidin-1-ylcarbonylpiperazin-1-yl)carbonylphenyl]methanone Openeye Name: [4-(methylamino)-3-nitro-phenyl]-[2-[4-(piperidine-1-carbonyl)piperazine-1-carbonyl]phenyl]methanone CAS Name: [4-(methylamino)-3-nitrophenyl]-[2-[oxo-[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]methyl]phenyl]methanone IUPAC Name: [4-(methylamino)-3-nitrophenyl]-[2-[4-(piperidine-1-carbonyl)piperazine-1-carbonyl]phenyl]methanone Traditional Name: [4-(methylamino)-3-nitro-phenyl]-[2-[4-(piperidine-1-carbonyl)piperazine-1-carbonyl]phenyl]methanone Formula: C25H29N5O5 MolecularWeight: 479.52826

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)N3CCN(CC3)C(=O)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)N3CCN(CC3)C(=O)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C25H29N5O5/c1-26-21-10-9-18(17-22(21)30(34)35)23(31)19-7-3-4-8-20(19)24(32)27-13-15-29(16-14-27)25(33)28-11-5-2-6-12-28/h3-4,7-10,17,26H,2,5-6,11-16H2,1H3