2-[4-[1-(3-cyclopentyloxy-4-methoxy-phenyl)-2-pyridin-4-yl-ethyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[1-(3-cyclopentyloxy-4-methoxy-phenyl)-2-pyridin-4-yl-ethyl]phenyl]ethanoic acid Openeye Name: 2-[4-[1-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-(4-pyridyl)ethyl]phenyl]acetic acid CAS Name: 2-[4-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethyl]phenyl]acetic acid IUPAC Name: 2-[4-[1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethyl]phenyl]acetic acid Traditional Name: 2-[4-[1-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-(4-pyridyl)ethyl]phenyl]acetic acid Formula: C27H29NO4 MolecularWeight: 431.52346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC2=CC=NC=C2)C3=CC=C(C=C3)CC(=O)O)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC2=CC=NC=C2)C3=CC=C(C=C3)CC(=O)O)OC4CCCC4

InChI

InChI=1S/C27H29NO4/c1-31-25-11-10-22(18-26(25)32-23-4-2-3-5-23)24(16-20-12-14-28-15-13-20)21-8-6-19(7-9-21)17-27(29)30/h6-15,18,23-24H,2-5,16-17H2,1H3,(H,29,30)