1-[4-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonylpiperidin-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[4-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonylpiperidin-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[4-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]-1-piperidyl]-3-phenyl-propan-1-one CAS Name: 1-[4-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-oxomethyl]-1-piperidinyl]-3-phenyl-1-propanone IUPAC Name: 1-[4-[4-(6-nitropyridin-3-yl)piperazine-1-carbonyl]piperidin-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[4-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]piperidino]-3-phenyl-propan-1-one Formula: C24H29N5O4 MolecularWeight: 451.51816

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-])C(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-])C(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C24H29N5O4/c30-23(9-6-19-4-2-1-3-5-19)27-12-10-20(11-13-27)24(31)28-16-14-26(15-17-28)21-7-8-22(25-18-21)29(32)33/h1-5,7-8,18,20H,6,9-17H2