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

Systemtic Name: 2-chloranyl-6-methyl-5,5-bis(oxidanylidene)benzo[c][5,1,2]benzoxathiazepine-3-carboxylate Openeye Name: 2-chloro-6-methyl-5,5-dioxo-benzo[c][5,1,2]benzoxathiazepine-3-carboxylate CAS Name: 2-chloro-6-methyl-5,5-dioxo-3-benzo[c][5,1,2]benzoxathiazepinecarboxylate IUPAC Name: 2-chloro-6-methyl-5,5-dioxobenzo[c][5,1,2]benzoxathiazepine-3-carboxylate Traditional Name: 2-chloro-5,5-diketo-6-methyl-benzo[c][5,1,2]benzoxathiazepine-3-carboxylate Formula: C14H9ClNO5S- MolecularWeight: 338.74296

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2OC3=C(S1(=O)=O)C=C(C(=C3)Cl)C(=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2OC3=C(S1(=O)=O)C=C(C(=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C14H10ClNO5S/c1-16-10-4-2-3-5-11(10)21-12-7-9(15)8(14(17)18)6-13(12)22(16,19)20/h2-7H,1H3,(H,17,18)/p-1