7-methoxy-3-(4-methoxyphenyl)-3-methyl-1H-isothiochromen-4-one

Systemtic Name: 7-methoxy-3-(4-methoxyphenyl)-3-methyl-1H-isothiochromen-4-one Openeye Name: 7-methoxy-3-(4-methoxyphenyl)-3-methyl-isothiochroman-4-one CAS Name: 7-methoxy-3-(4-methoxyphenyl)-3-methyl-1H-2-benzothiopyran-4-one IUPAC Name: 7-methoxy-3-(4-methoxyphenyl)-3-methyl-1H-isothiochromen-4-one Traditional Name: 7-methoxy-3-(4-methoxyphenyl)-3-methyl-isothiochroman-4-one Formula: C18H18O3S MolecularWeight: 314.39872

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=C(CS1)C=C(C=C2)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1(C(=O)C2=C(CS1)C=C(C=C2)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H18O3S/c1-18(13-4-6-14(20-2)7-5-13)17(19)16-9-8-15(21-3)10-12(16)11-22-18/h4-10H,11H2,1-3H3