N-[2-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: 3-nitro-N-[2-oxo-2-[4-[2-(p-tolyl)ethyl]-1-piperidyl]ethyl]benzamide CAS Name: N-[2-[4-[2-(4-methylphenyl)ethyl]-1-piperidinyl]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-keto-2-[4-[2-(p-tolyl)ethyl]piperidino]ethyl]-3-nitro-benzamide Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H27N3O4/c1-17-5-7-18(8-6-17)9-10-19-11-13-25(14-12-19)22(27)16-24-23(28)20-3-2-4-21(15-20)26(29)30/h2-8,15,19H,9-14,16H2,1H3,(H,24,28)