7,8-dimethyl-4-(methylsulfonylmethyl)chromen-2-one

Systemtic Name: 7,8-dimethyl-4-(methylsulfonylmethyl)chromen-2-one Openeye Name: 7,8-dimethyl-4-(methylsulfonylmethyl)chromen-2-one CAS Name: 7,8-dimethyl-4-(methylsulfonylmethyl)-1-benzopyran-2-one IUPAC Name: 7,8-dimethyl-4-(methylsulfonylmethyl)chromen-2-one Traditional Name: 4-(mesylmethyl)-7,8-dimethyl-coumarin Formula: C13H14O4S MolecularWeight: 266.31286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CS(=O)(=O)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CS(=O)(=O)C)C

InChI

InChI=1S/C13H14O4S/c1-8-4-5-11-10(7-18(3,15)16)6-12(14)17-13(11)9(8)2/h4-6H,7H2,1-3H3