ethyl 2-cyano-2-[1-(phenylmethyl)piperidin-4-yl]ethanoate

Systemtic Name: ethyl 2-cyano-2-[1-(phenylmethyl)piperidin-4-yl]ethanoate Openeye Name: ethyl 2-(1-benzyl-4-piperidyl)-2-cyano-acetate CAS Name: 2-cyano-2-[1-(phenylmethyl)-4-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(1-benzylpiperidin-4-yl)-2-cyanoacetate Traditional Name: 2-(1-benzyl-4-piperidyl)-2-cyano-acetic acid ethyl ester Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C#N)C1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O2/c1-2-21-17(20)16(12-18)15-8-10-19(11-9-15)13-14-6-4-3-5-7-14/h3-7,15-16H,2,8-11,13H2,1H3