3-(3-cyclopentyloxy-4-methoxy-phenyl)-3-oxidanyl-3-pyridin-2-yl-propanenitrile

Systemtic Name: 3-(3-cyclopentyloxy-4-methoxy-phenyl)-3-oxidanyl-3-pyridin-2-yl-propanenitrile Openeye Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-hydroxy-3-(2-pyridyl)propanenitrile CAS Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-hydroxy-3-(2-pyridinyl)propanenitrile IUPAC Name: 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-hydroxy-3-pyridin-2-ylpropanenitrile Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-phenyl]-3-hydroxy-3-(2-pyridyl)propionitrile Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC#N)(C2=CC=CC=N2)O)OC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC#N)(C2=CC=CC=N2)O)OC3CCCC3

InChI

InChI=1S/C20H22N2O3/c1-24-17-10-9-15(14-18(17)25-16-6-2-3-7-16)20(23,11-12-21)19-8-4-5-13-22-19/h4-5,8-10,13-14,16,23H,2-3,6-7,11H2,1H3