methyl 4-[1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]benzoate

Systemtic Name: methyl 4-[1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-4-yl]benzoate Openeye Name: methyl 4-(1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)benzoate CAS Name: 4-(1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-4-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl)benzoate Traditional Name: 4-(1,1-diketo-3,4-dihydro-2H-thiochromen-4-yl)benzoic acid methyl ester Formula: C17H16O4S MolecularWeight: 316.37154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2CCS(=O)(=O)C3=CC=CC=C23

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2CCS(=O)(=O)C3=CC=CC=C23

InChI

InChI=1S/C17H16O4S/c1-21-17(18)13-8-6-12(7-9-13)14-10-11-22(19,20)16-5-3-2-4-15(14)16/h2-9,14H,10-11H2,1H3