methyl 5,12-dimethoxy-6,11-bis(oxidanylidene)-3,4-dihydro-1H-naphtho[2,3-g]isothiochromene-3-carboxylate

Systemtic Name: methyl 5,12-dimethoxy-6,11-bis(oxidanylidene)-3,4-dihydro-1H-naphtho[2,3-g]isothiochromene-3-carboxylate Openeye Name: methyl 5,12-dimethoxy-6,11-dioxo-3,4-dihydro-1H-naphtho[2,3-g]isothiochromene-3-carboxylate CAS Name: 5,12-dimethoxy-6,11-dioxo-3,4-dihydro-1H-naphtho[2,3-g]isothiochromene-3-carboxylic acid methyl ester IUPAC Name: methyl 5,12-dimethoxy-6,11-dioxo-3,4-dihydro-1H-naphtho[2,3-g]isothiochromene-3-carboxylate Traditional Name: 6,11-diketo-5,12-dimethoxy-3,4-dihydro-1H-naphth[2,3-g]isothiochromene-3-carboxylic acid methyl ester Formula: C21H18O6S MolecularWeight: 398.42902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CC(SCC2=C(C3=C1C(=O)C4=CC=CC=C4C3=O)OC)C(=O)OC

Isomeric SMILES

COC1=C2CC(SCC2=C(C3=C1C(=O)C4=CC=CC=C4C3=O)OC)C(=O)OC

InChI

InChI=1S/C21H18O6S/c1-25-19-12-8-14(21(24)27-3)28-9-13(12)20(26-2)16-15(19)17(22)10-6-4-5-7-11(10)18(16)23/h4-7,14H,8-9H2,1-3H3