phenyl 2-cyclohexyl-3-oxidanyl-3-pyridin-2-yl-pentanoate

Systemtic Name: phenyl 2-cyclohexyl-3-oxidanyl-3-pyridin-2-yl-pentanoate Openeye Name: phenyl 2-cyclohexyl-3-hydroxy-3-(2-pyridyl)pentanoate CAS Name: 2-cyclohexyl-3-hydroxy-3-(2-pyridinyl)pentanoic acid phenyl ester IUPAC Name: phenyl 2-cyclohexyl-3-hydroxy-3-pyridin-2-ylpentanoate Traditional Name: 2-cyclohexyl-3-hydroxy-3-(2-pyridyl)valeric acid phenyl ester Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=N1)(C(C2CCCCC2)C(=O)OC3=CC=CC=C3)O

Isomeric SMILES

CCC(C1=CC=CC=N1)(C(C2CCCCC2)C(=O)OC3=CC=CC=C3)O

InChI

InChI=1S/C22H27NO3/c1-2-22(25,19-15-9-10-16-23-19)20(17-11-5-3-6-12-17)21(24)26-18-13-7-4-8-14-18/h4,7-10,13-17,20,25H,2-3,5-6,11-12H2,1H3