2,2-dimethoxy-5-(3-methylsulfanylphenyl)indene-1,3-dione

Systemtic Name: 2,2-dimethoxy-5-(3-methylsulfanylphenyl)indene-1,3-dione Openeye Name: 2,2-dimethoxy-5-(3-methylsulfanylphenyl)indane-1,3-dione CAS Name: 2,2-dimethoxy-5-[3-(methylthio)phenyl]indene-1,3-dione IUPAC Name: 2,2-dimethoxy-5-(3-methylsulfanylphenyl)indene-1,3-dione Traditional Name: 2,2-dimethoxy-5-[3-(methylthio)phenyl]indane-1,3-quinone Formula: C18H16O4S MolecularWeight: 328.38224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16O4S/c1-21-18(22-2)16(19)14-8-7-12(10-15(14)17(18)20)11-5-4-6-13(9-11)23-3/h4-10H,1-3H3