2-(5-methyl-2-oxidanyl-3-phenylsulfanyl-phenyl)cyclohexan-1-one

Systemtic Name: 2-(5-methyl-2-oxidanyl-3-phenylsulfanyl-phenyl)cyclohexan-1-one Openeye Name: 2-(2-hydroxy-5-methyl-3-phenylsulfanyl-phenyl)cyclohexanone CAS Name: 2-[2-hydroxy-5-methyl-3-(phenylthio)phenyl]-1-cyclohexanone IUPAC Name: 2-(2-hydroxy-5-methyl-3-phenylsulfanylphenyl)cyclohexan-1-one Traditional Name: 2-[2-hydroxy-5-methyl-3-(phenylthio)phenyl]cyclohexanone Formula: C19H20O2S MolecularWeight: 312.4259

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2CCCCC2=O)O)SC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C(=C1)C2CCCCC2=O)O)SC3=CC=CC=C3

InChI

InChI=1S/C19H20O2S/c1-13-11-16(15-9-5-6-10-17(15)20)19(21)18(12-13)22-14-7-3-2-4-8-14/h2-4,7-8,11-12,15,21H,5-6,9-10H2,1H3