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

Systemtic Name: ethyl 2-cyano-2-[4-naphthalen-2-yl-1-(phenylmethyl)piperidin-4-yl]ethanoate Openeye Name: ethyl 2-[1-benzyl-4-(2-naphthyl)-4-piperidyl]-2-cyano-acetate CAS Name: 2-cyano-2-[4-(2-naphthalenyl)-1-(phenylmethyl)-4-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(1-benzyl-4-naphthalen-2-ylpiperidin-4-yl)-2-cyanoacetate Traditional Name: 2-[1-benzyl-4-(2-naphthyl)-4-piperidyl]-2-cyano-acetic acid ethyl ester Formula: C27H28N2O2 MolecularWeight: 412.52342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1(CCN(CC1)CC2=CC=CC=C2)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)C(C#N)C1(CCN(CC1)CC2=CC=CC=C2)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H28N2O2/c1-2-31-26(30)25(19-28)27(24-13-12-22-10-6-7-11-23(22)18-24)14-16-29(17-15-27)20-21-8-4-3-5-9-21/h3-13,18,25H,2,14-17,20H2,1H3