1-[4-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonylpiperidin-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[4-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonylpiperidin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]-1-piperidyl]-2-phenoxy-ethanone CAS Name: 1-[4-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-oxomethyl]-1-piperidinyl]-2-phenoxyethanone IUPAC Name: 1-[4-[4-(6-nitropyridin-3-yl)piperazine-1-carbonyl]piperidin-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]piperidino]-2-phenoxy-ethanone Formula: C23H27N5O5 MolecularWeight: 453.49098

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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)COC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-])C(=O)COC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O5/c29-22(17-33-20-4-2-1-3-5-20)26-10-8-18(9-11-26)23(30)27-14-12-25(13-15-27)19-6-7-21(24-16-19)28(31)32/h1-7,16,18H,8-15,17H2