3-(4-hydroxyphenyl)-7,8-dimethoxy-1H-isothiochromen-4-one

Systemtic Name: 3-(4-hydroxyphenyl)-7,8-dimethoxy-1H-isothiochromen-4-one Openeye Name: 3-(4-hydroxyphenyl)-7,8-dimethoxy-isothiochroman-4-one CAS Name: 3-(4-hydroxyphenyl)-7,8-dimethoxy-1H-2-benzothiopyran-4-one IUPAC Name: 3-(4-hydroxyphenyl)-7,8-dimethoxy-1H-isothiochromen-4-one Traditional Name: 3-(4-hydroxyphenyl)-7,8-dimethoxy-isothiochroman-4-one Formula: C17H16O4S MolecularWeight: 316.37154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=O)C(SC2)C3=CC=C(C=C3)O)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=O)C(SC2)C3=CC=C(C=C3)O)OC

InChI

InChI=1S/C17H16O4S/c1-20-14-8-7-12-13(16(14)21-2)9-22-17(15(12)19)10-3-5-11(18)6-4-10/h3-8,17-18H,9H2,1-2H3