[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl] 3-cyanobenzoate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl] 3-cyanobenzoate Openeye Name: [2-(4-benzyl-1-piperidyl)-2-oxo-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl] ester IUPAC Name: [2-(4-benzylpiperidin-1-yl)-2-oxoethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-(4-benzylpiperidino)-2-keto-ethyl] ester Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)COC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)COC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C22H22N2O3/c23-15-19-7-4-8-20(14-19)22(26)27-16-21(25)24-11-9-18(10-12-24)13-17-5-2-1-3-6-17/h1-8,14,18H,9-13,16H2