5-(4-methoxyphenyl)carbonyl-2-methyl-1,2-thiazol-3-one

Systemtic Name: 5-(4-methoxyphenyl)carbonyl-2-methyl-1,2-thiazol-3-one Openeye Name: 5-(4-methoxybenzoyl)-2-methyl-isothiazol-3-one CAS Name: 5-[(4-methoxyphenyl)-oxomethyl]-2-methyl-3-isothiazolone IUPAC Name: 5-(4-methoxybenzoyl)-2-methyl-1,2-thiazol-3-one Traditional Name: 2-methyl-5-p-anisoyl-4-isothiazolin-3-one Formula: C12H11NO3S MolecularWeight: 249.28564

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(S1)C(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CN1C(=O)C=C(S1)C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C12H11NO3S/c1-13-11(14)7-10(17-13)12(15)8-3-5-9(16-2)6-4-8/h3-7H,1-2H3