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

Systemtic Name: [1-(3-cyclopentyloxy-4-methoxy-phenyl)-2-pyridin-4-yl-ethyl] benzoate Openeye Name: [1-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-(4-pyridyl)ethyl] benzoate CAS Name: benzoic acid [1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethyl] ester IUPAC Name: [1-(3-cyclopentyloxy-4-methoxyphenyl)-2-pyridin-4-ylethyl] benzoate Traditional Name: benzoic acid [1-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-(4-pyridyl)ethyl] ester Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27NO4/c1-29-23-12-11-21(18-25(23)30-22-9-5-6-10-22)24(17-19-13-15-27-16-14-19)31-26(28)20-7-3-2-4-8-20/h2-4,7-8,11-16,18,22,24H,5-6,9-10,17H2,1H3