cyanomethyl 1-(4-methoxyphenyl)-6-oxidanylidene-2-phenyl-piperidine-3-carboxylate

Systemtic Name: cyanomethyl 1-(4-methoxyphenyl)-6-oxidanylidene-2-phenyl-piperidine-3-carboxylate Openeye Name: cyanomethyl 1-(4-methoxyphenyl)-6-oxo-2-phenyl-piperidine-3-carboxylate CAS Name: 1-(4-methoxyphenyl)-6-oxo-2-phenyl-3-piperidinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 1-(4-methoxyphenyl)-6-oxo-2-phenylpiperidine-3-carboxylate Traditional Name: 6-keto-1-(4-methoxyphenyl)-2-phenyl-nipecotic acid cyanomethyl ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)OCC#N)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)OCC#N)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O4/c1-26-17-9-7-16(8-10-17)23-19(24)12-11-18(21(25)27-14-13-22)20(23)15-5-3-2-4-6-15/h2-10,18,20H,11-12,14H2,1H3