2-[4-cyano-4-(3,4-dimethoxyphenyl)piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[4-cyano-4-(3,4-dimethoxyphenyl)piperidin-1-yl]ethanoic acid Openeye Name: 2-[4-cyano-4-(3,4-dimethoxyphenyl)-1-piperidyl]acetic acid CAS Name: 2-[4-cyano-4-(3,4-dimethoxyphenyl)-1-piperidinyl]acetic acid IUPAC Name: 2-[4-cyano-4-(3,4-dimethoxyphenyl)piperidin-1-yl]acetic acid Traditional Name: 2-[4-cyano-4-(3,4-dimethoxyphenyl)piperidino]acetic acid Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O4/c1-21-13-4-3-12(9-14(13)22-2)16(11-17)5-7-18(8-6-16)10-15(19)20/h3-4,9H,5-8,10H2,1-2H3,(H,19,20)