2-[4-cyano-4-(3-cyclopentyloxy-4-propan-2-yloxy-phenyl)piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[4-cyano-4-(3-cyclopentyloxy-4-propan-2-yloxy-phenyl)piperidin-1-yl]ethanoic acid Openeye Name: 2-[4-cyano-4-[3-(cyclopentoxy)-4-isopropoxy-phenyl]-1-piperidyl]acetic acid CAS Name: 2-[4-cyano-4-(3-cyclopentyloxy-4-propan-2-yloxyphenyl)-1-piperidinyl]acetic acid IUPAC Name: 2-[4-cyano-4-(3-cyclopentyloxy-4-propan-2-yloxyphenyl)piperidin-1-yl]acetic acid Traditional Name: 2-[4-cyano-4-[3-(cyclopentoxy)-4-isopropoxy-phenyl]piperidino]acetic acid Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C2(CCN(CC2)CC(=O)O)C#N)OC3CCCC3

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C2(CCN(CC2)CC(=O)O)C#N)OC3CCCC3

InChI

InChI=1S/C22H30N2O4/c1-16(2)27-19-8-7-17(13-20(19)28-18-5-3-4-6-18)22(15-23)9-11-24(12-10-22)14-21(25)26/h7-8,13,16,18H,3-6,9-12,14H2,1-2H3,(H,25,26)