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

Systemtic Name: 6-methyl-5,5-bis(oxidanylidene)benzo[c][5,2,1]benzoxathiazepine-3-carboxylic acid Openeye Name: 6-methyl-5,5-dioxo-benzo[c][5,2,1]benzoxathiazepine-3-carboxylic acid CAS Name: 6-methyl-5,5-dioxo-3-benzo[c][5,2,1]benzoxathiazepinecarboxylic acid IUPAC Name: 6-methyl-5,5-dioxobenzo[c][5,2,1]benzoxathiazepine-3-carboxylic acid Traditional Name: 5,5-diketo-6-methyl-benzo[c][5,2,1]benzoxathiazepine-3-carboxylic acid Formula: C14H11NO5S MolecularWeight: 305.30584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO5S/c1-15-10-4-2-3-5-11(10)20-12-7-6-9(14(16)17)8-13(12)21(15,18)19/h2-8H,1H3,(H,16,17)