5-nitro-2-oxidanylidene-1-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]pyridine-3-carbonitrile

Systemtic Name: 5-nitro-2-oxidanylidene-1-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]pyridine-3-carbonitrile Openeye Name: 1-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]-5-nitro-2-oxo-pyridine-3-carbonitrile CAS Name: 5-nitro-2-oxo-1-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-3-pyridinecarbonitrile IUPAC Name: 1-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-5-nitro-2-oxopyridine-3-carbonitrile Traditional Name: 1-[2-(4-benzylpiperidino)-2-keto-ethyl]-2-keto-5-nitro-nicotinonitrile Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4/c21-12-17-11-18(24(27)28)13-23(20(17)26)14-19(25)22-8-6-16(7-9-22)10-15-4-2-1-3-5-15/h1-5,11,13,16H,6-10,14H2