2-[[4-(3-ethanoylphenyl)phenyl]methyl]-2,4-dimethyl-5-oxidanyl-thiophen-3-one

Systemtic Name: 2-[[4-(3-ethanoylphenyl)phenyl]methyl]-2,4-dimethyl-5-oxidanyl-thiophen-3-one Openeye Name: 2-[[4-(3-acetylphenyl)phenyl]methyl]-5-hydroxy-2,4-dimethyl-thiophen-3-one CAS Name: 2-[[4-(3-acetylphenyl)phenyl]methyl]-5-hydroxy-2,4-dimethyl-3-thiophenone IUPAC Name: 2-[[4-(3-acetylphenyl)phenyl]methyl]-5-hydroxy-2,4-dimethylthiophen-3-one Traditional Name: 2-[4-(3-acetylphenyl)benzyl]-5-hydroxy-2,4-dimethyl-thiophen-3-one Formula: C21H20O3S MolecularWeight: 352.4467

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(C1=O)(C)CC2=CC=C(C=C2)C3=CC(=CC=C3)C(=O)C)O

Isomeric SMILES

CC1=C(SC(C1=O)(C)CC2=CC=C(C=C2)C3=CC(=CC=C3)C(=O)C)O

InChI

InChI=1S/C21H20O3S/c1-13-19(23)21(3,25-20(13)24)12-15-7-9-16(10-8-15)18-6-4-5-17(11-18)14(2)22/h4-11,24H,12H2,1-3H3