4-(3-methylphenyl)carbonyl-5-oxidanyl-thiophen-3-one

Systemtic Name: 4-(3-methylphenyl)carbonyl-5-oxidanyl-thiophen-3-one Openeye Name: 5-hydroxy-4-(3-methylbenzoyl)thiophen-3-one CAS Name: 5-hydroxy-4-[(3-methylphenyl)-oxomethyl]-3-thiophenone IUPAC Name: 5-hydroxy-4-(3-methylbenzoyl)thiophen-3-one Traditional Name: 5-hydroxy-4-m-toluoyl-thiophen-3-one Formula: C12H10O3S MolecularWeight: 234.271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C2=C(SCC2=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)C2=C(SCC2=O)O

InChI

InChI=1S/C12H10O3S/c1-7-3-2-4-8(5-7)11(14)10-9(13)6-16-12(10)15/h2-5,15H,6H2,1H3