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

Systemtic Name: 2-[4-cyano-4-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]piperidin-1-yl]ethanoic acid Openeye Name: 2-[4-cyano-4-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-1-piperidyl]acetic acid CAS Name: 2-[4-cyano-4-[3-(cyclopropylmethoxy)-4-methoxyphenyl]-1-piperidinyl]acetic acid IUPAC Name: 2-[4-cyano-4-[3-(cyclopropylmethoxy)-4-methoxyphenyl]piperidin-1-yl]acetic acid Traditional Name: 2-[4-cyano-4-[3-(cyclopropylmethoxy)-4-methoxy-phenyl]piperidino]acetic acid Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCN(CC2)CC(=O)O)C#N)OCC3CC3

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCN(CC2)CC(=O)O)C#N)OCC3CC3

InChI

InChI=1S/C19H24N2O4/c1-24-16-5-4-15(10-17(16)25-12-14-2-3-14)19(13-20)6-8-21(9-7-19)11-18(22)23/h4-5,10,14H,2-3,6-9,11-12H2,1H3,(H,22,23)