[4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]-[4-(2-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(3-methylpiperidin-1-yl)-3-nitro-phenyl]-[4-(2-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [4-(3-methyl-1-piperidyl)-3-nitro-phenyl]-[4-(2-nitrophenyl)piperazin-1-yl]methanone CAS Name: [4-(3-methyl-1-piperidinyl)-3-nitrophenyl]-[4-(2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [4-(3-methylpiperidin-1-yl)-3-nitrophenyl]-[4-(2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [4-(3-methylpiperidino)-3-nitro-phenyl]-[4-(2-nitrophenyl)piperazino]methanone Formula: C23H27N5O5 MolecularWeight: 453.49098

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H27N5O5/c1-17-5-4-10-26(16-17)20-9-8-18(15-22(20)28(32)33)23(29)25-13-11-24(12-14-25)19-6-2-3-7-21(19)27(30)31/h2-3,6-9,15,17H,4-5,10-14,16H2,1H3