(2E)-2-[(3-chlorophenyl)methylidene]-4-methyl-3-oxidanylidene-1,4-benzothiazine-6-carboxylic acid

Systemtic Name: (2E)-2-[(3-chlorophenyl)methylidene]-4-methyl-3-oxidanylidene-1,4-benzothiazine-6-carboxylic acid Openeye Name: (2E)-2-[(3-chlorophenyl)methylene]-4-methyl-3-oxo-1,4-benzothiazine-6-carboxylic acid CAS Name: (2E)-2-[(3-chlorophenyl)methylidene]-4-methyl-3-oxo-1,4-benzothiazine-6-carboxylic acid IUPAC Name: (2E)-2-[(3-chlorophenyl)methylidene]-4-methyl-3-oxo-1,4-benzothiazine-6-carboxylic acid Traditional Name: (2E)-2-(3-chlorobenzylidene)-3-keto-4-methyl-1,4-benzothiazine-6-carboxylic acid Formula: C17H12ClNO3S MolecularWeight: 345.80008

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C(=O)O)SC(=CC3=CC(=CC=C3)Cl)C1=O

Isomeric SMILES

CN1C2=C(C=CC(=C2)C(=O)O)S/C(=C/C3=CC(=CC=C3)Cl)/C1=O

InChI

InChI=1S/C17H12ClNO3S/c1-19-13-9-11(17(21)22)5-6-14(13)23-15(16(19)20)8-10-3-2-4-12(18)7-10/h2-9H,1H3,(H,21,22)/b15-8+