methyl 4-[[4,4-bis(oxidanylidene)-5-phenyl-2,3-dihydro-1,4-oxathiin-6-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[4,4-bis(oxidanylidene)-5-phenyl-2,3-dihydro-1,4-oxathiin-6-yl]carbonylamino]benzoate Openeye Name: methyl 4-[(4,4-dioxo-5-phenyl-2,3-dihydro-1,4-oxathiine-6-carbonyl)amino]benzoate CAS Name: 4-[[(4,4-dioxo-5-phenyl-2,3-dihydro-1,4-oxathiin-6-yl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(4,4-dioxo-5-phenyl-2,3-dihydro-1,4-oxathiine-6-carbonyl)amino]benzoate Traditional Name: 4-[(4,4-diketo-5-phenyl-2,3-dihydro-1,4-oxathiin-6-carbonyl)amino]benzoic acid methyl ester Formula: C19H17NO6S MolecularWeight: 387.40638

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(S(=O)(=O)CCO2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(S(=O)(=O)CCO2)C3=CC=CC=C3

InChI

InChI=1S/C19H17NO6S/c1-25-19(22)14-7-9-15(10-8-14)20-18(21)16-17(13-5-3-2-4-6-13)27(23,24)12-11-26-16/h2-10H,11-12H2,1H3,(H,20,21)