2-[4-cyano-4-(4-methoxy-3-phenylmethoxy-phenyl)piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[4-cyano-4-(4-methoxy-3-phenylmethoxy-phenyl)piperidin-1-yl]ethanoic acid Openeye Name: 2-[4-(3-benzyloxy-4-methoxy-phenyl)-4-cyano-1-piperidyl]acetic acid CAS Name: 2-[4-cyano-4-(4-methoxy-3-phenylmethoxyphenyl)-1-piperidinyl]acetic acid IUPAC Name: 2-[4-cyano-4-(4-methoxy-3-phenylmethoxyphenyl)piperidin-1-yl]acetic acid Traditional Name: 2-[4-(3-benzoxy-4-methoxy-phenyl)-4-cyano-piperidino]acetic acid Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCN(CC2)CC(=O)O)C#N)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCN(CC2)CC(=O)O)C#N)OCC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O4/c1-27-19-8-7-18(13-20(19)28-15-17-5-3-2-4-6-17)22(16-23)9-11-24(12-10-22)14-21(25)26/h2-8,13H,9-12,14-15H2,1H3,(H,25,26)