5-methoxy-2,2-dimethyl-3H-thiochromen-4-one

Systemtic Name: 5-methoxy-2,2-dimethyl-3H-thiochromen-4-one Openeye Name: 5-methoxy-2,2-dimethyl-thiochroman-4-one CAS Name: 5-methoxy-2,2-dimethyl-3H-1-benzothiopyran-4-one IUPAC Name: 5-methoxy-2,2-dimethyl-3H-thiochromen-4-one Traditional Name: 5-methoxy-2,2-dimethyl-thiochroman-4-one Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(C=CC=C2S1)OC)C

Isomeric SMILES

CC1(CC(=O)C2=C(C=CC=C2S1)OC)C

InChI

InChI=1S/C12H14O2S/c1-12(2)7-8(13)11-9(14-3)5-4-6-10(11)15-12/h4-6H,7H2,1-3H3