5,5-dimethyl-4-(4-methylsulfanylphenyl)-3-phenoxy-furan-2-one

Systemtic Name: 5,5-dimethyl-4-(4-methylsulfanylphenyl)-3-phenoxy-furan-2-one Openeye Name: 5,5-dimethyl-4-(4-methylsulfanylphenyl)-3-phenoxy-furan-2-one CAS Name: 5,5-dimethyl-4-[4-(methylthio)phenyl]-3-phenoxy-2-furanone IUPAC Name: 5,5-dimethyl-4-(4-methylsulfanylphenyl)-3-phenoxyfuran-2-one Traditional Name: 5,5-dimethyl-4-[4-(methylthio)phenyl]-3-phenoxy-furan-2-one Formula: C19H18O3S MolecularWeight: 326.40942

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=O)O1)OC2=CC=CC=C2)C3=CC=C(C=C3)SC)C

Isomeric SMILES

CC1(C(=C(C(=O)O1)OC2=CC=CC=C2)C3=CC=C(C=C3)SC)C

InChI

InChI=1S/C19H18O3S/c1-19(2)16(13-9-11-15(23-3)12-10-13)17(18(20)22-19)21-14-7-5-4-6-8-14/h4-12H,1-3H3