(phenylmethyl) 1-[4-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)piperidin-1-yl]cyclopropane-1-carboxylate

Systemtic Name: (phenylmethyl) 1-[4-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)piperidin-1-yl]cyclopropane-1-carboxylate Openeye Name: benzyl 1-[4-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]-1-piperidyl]cyclopropanecarboxylate CAS Name: 1-[4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)-1-piperidinyl]-1-cyclopropanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-[4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)piperidin-1-yl]cyclopropane-1-carboxylate Traditional Name: 1-[4-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]piperidino]cyclopropanecarboxylic acid benzyl ester Formula: C29H34N2O4 MolecularWeight: 474.59126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCN(CC2)C3(CC3)C(=O)OCC4=CC=CC=C4)C#N)OC5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCN(CC2)C3(CC3)C(=O)OCC4=CC=CC=C4)C#N)OC5CCCC5

InChI

InChI=1S/C29H34N2O4/c1-33-25-12-11-23(19-26(25)35-24-9-5-6-10-24)28(21-30)15-17-31(18-16-28)29(13-14-29)27(32)34-20-22-7-3-2-4-8-22/h2-4,7-8,11-12,19,24H,5-6,9-10,13-18,20H2,1H3