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

Systemtic Name: cyanomethyl 1,2-bis(4-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxylate Openeye Name: cyanomethyl 1,2-bis(4-methoxyphenyl)-6-oxo-piperidine-3-carboxylate CAS Name: 1,2-bis(4-methoxyphenyl)-6-oxo-3-piperidinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 1,2-bis(4-methoxyphenyl)-6-oxopiperidine-3-carboxylate Traditional Name: 6-keto-1,2-bis(4-methoxyphenyl)nipecotic acid cyanomethyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(CCC(=O)N2C3=CC=C(C=C3)OC)C(=O)OCC#N

Isomeric SMILES

COC1=CC=C(C=C1)C2C(CCC(=O)N2C3=CC=C(C=C3)OC)C(=O)OCC#N

InChI

InChI=1S/C22H22N2O5/c1-27-17-7-3-15(4-8-17)21-19(22(26)29-14-13-23)11-12-20(25)24(21)16-5-9-18(28-2)10-6-16/h3-10,19,21H,11-12,14H2,1-2H3