6-cyclohexyl-4-methoxy-3-(phenylsulfanylmethyl)pyran-2-one

Systemtic Name: 6-cyclohexyl-4-methoxy-3-(phenylsulfanylmethyl)pyran-2-one Openeye Name: 6-cyclohexyl-4-methoxy-3-(phenylsulfanylmethyl)pyran-2-one CAS Name: 6-cyclohexyl-4-methoxy-3-[(phenylthio)methyl]-2-pyranone IUPAC Name: 6-cyclohexyl-4-methoxy-3-(phenylsulfanylmethyl)pyran-2-one Traditional Name: 6-cyclohexyl-4-methoxy-3-[(phenylthio)methyl]pyran-2-one Formula: C19H22O3S MolecularWeight: 330.44118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)OC(=C1)C2CCCCC2)CSC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=O)OC(=C1)C2CCCCC2)CSC3=CC=CC=C3

InChI

InChI=1S/C19H22O3S/c1-21-18-12-17(14-8-4-2-5-9-14)22-19(20)16(18)13-23-15-10-6-3-7-11-15/h3,6-7,10-12,14H,2,4-5,8-9,13H2,1H3