1-[4-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)piperidin-1-yl]cyclopropane-1-carboxylic acid

Systemtic Name: 1-[4-cyano-4-(3-cyclopentyloxy-4-methoxy-phenyl)piperidin-1-yl]cyclopropane-1-carboxylic acid Openeye Name: 1-[4-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]-1-piperidyl]cyclopropanecarboxylic acid CAS Name: 1-[4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)-1-piperidinyl]-1-cyclopropanecarboxylic acid IUPAC Name: 1-[4-cyano-4-(3-cyclopentyloxy-4-methoxyphenyl)piperidin-1-yl]cyclopropane-1-carboxylic acid Traditional Name: 1-[4-cyano-4-[3-(cyclopentoxy)-4-methoxy-phenyl]piperidino]cyclopropanecarboxylic acid Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCN(CC2)C3(CC3)C(=O)O)C#N)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCN(CC2)C3(CC3)C(=O)O)C#N)OC4CCCC4

InChI

InChI=1S/C22H28N2O4/c1-27-18-7-6-16(14-19(18)28-17-4-2-3-5-17)21(15-23)10-12-24(13-11-21)22(8-9-22)20(25)26/h6-7,14,17H,2-5,8-13H2,1H3,(H,25,26)