2,6-dimethyl-5-oxidanylidene-6-(phenylsulfanylmethyl)cyclohexene-1-carbaldehyde

Systemtic Name: 2,6-dimethyl-5-oxidanylidene-6-(phenylsulfanylmethyl)cyclohexene-1-carbaldehyde Openeye Name: 2,6-dimethyl-5-oxo-6-(phenylsulfanylmethyl)cyclohexene-1-carbaldehyde CAS Name: 2,6-dimethyl-5-oxo-6-[(phenylthio)methyl]-1-cyclohexenecarboxaldehyde IUPAC Name: 2,6-dimethyl-5-oxo-6-(phenylsulfanylmethyl)cyclohexene-1-carbaldehyde Traditional Name: 5-keto-2,6-dimethyl-6-[(phenylthio)methyl]cyclohexene-1-carbaldehyde Formula: C16H18O2S MolecularWeight: 274.37792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=O)CC1)(C)CSC2=CC=CC=C2)C=O

Isomeric SMILES

CC1=C(C(C(=O)CC1)(C)CSC2=CC=CC=C2)C=O

InChI

InChI=1S/C16H18O2S/c1-12-8-9-15(18)16(2,14(12)10-17)11-19-13-6-4-3-5-7-13/h3-7,10H,8-9,11H2,1-2H3