[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-(2-cyanophenyl)benzoate

Systemtic Name: [2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-(2-cyanophenyl)benzoate Openeye Name: [2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl] 2-(2-cyanophenyl)benzoate CAS Name: 2-(2-cyanophenyl)benzoic acid [2-[(2S)-2-methyl-1-piperidinyl]-2-oxoethyl] ester IUPAC Name: [2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-(2-cyanophenyl)benzoate Traditional Name: 2-(2-cyanophenyl)benzoic acid [2-keto-2-[(2S)-2-methylpiperidino]ethyl] ester Formula: C22H22N2O3 MolecularWeight: 362.42168

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)COC(=O)C2=CC=CC=C2C3=CC=CC=C3C#N

Isomeric SMILES

C[C@H]1CCCCN1C(=O)COC(=O)C2=CC=CC=C2C3=CC=CC=C3C#N

InChI

InChI=1S/C22H22N2O3/c1-16-8-6-7-13-24(16)21(25)15-27-22(26)20-12-5-4-11-19(20)18-10-3-2-9-17(18)14-23/h2-5,9-12,16H,6-8,13,15H2,1H3/t16-/m0/s1