methyl 6-methyl-5,5-bis(oxidanylidene)benzo[c][5,2,1]benzoxathiazepine-3-carboxylate

Systemtic Name: methyl 6-methyl-5,5-bis(oxidanylidene)benzo[c][5,2,1]benzoxathiazepine-3-carboxylate Openeye Name: methyl 6-methyl-5,5-dioxo-benzo[c][5,2,1]benzoxathiazepine-3-carboxylate CAS Name: 6-methyl-5,5-dioxo-3-benzo[c][5,2,1]benzoxathiazepinecarboxylic acid methyl ester IUPAC Name: methyl 6-methyl-5,5-dioxobenzo[c][5,2,1]benzoxathiazepine-3-carboxylate Traditional Name: 5,5-diketo-6-methyl-benzo[c][5,2,1]benzoxathiazepine-3-carboxylic acid methyl ester Formula: C15H13NO5S MolecularWeight: 319.33242

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2OC3=C(S1(=O)=O)C=C(C=C3)C(=O)OC

Isomeric SMILES

CN1C2=CC=CC=C2OC3=C(S1(=O)=O)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C15H13NO5S/c1-16-11-5-3-4-6-12(11)21-13-8-7-10(15(17)20-2)9-14(13)22(16,18)19/h3-9H,1-2H3