2-[(2E)-2-[(3-chlorophenyl)methylidene]-3-oxidanylidene-1,4-benzothiazin-4-yl]ethanoic acid

Systemtic Name: 2-[(2E)-2-[(3-chlorophenyl)methylidene]-3-oxidanylidene-1,4-benzothiazin-4-yl]ethanoic acid Openeye Name: 2-[(2E)-2-[(3-chlorophenyl)methylene]-3-oxo-1,4-benzothiazin-4-yl]acetic acid CAS Name: 2-[(2E)-2-[(3-chlorophenyl)methylidene]-3-oxo-1,4-benzothiazin-4-yl]acetic acid IUPAC Name: 2-[(2E)-2-[(3-chlorophenyl)methylidene]-3-oxo-1,4-benzothiazin-4-yl]acetic acid Traditional Name: 2-[(2E)-2-(3-chlorobenzylidene)-3-keto-1,4-benzothiazin-4-yl]acetic acid Formula: C17H12ClNO3S MolecularWeight: 345.80008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)C(=CC3=CC(=CC=C3)Cl)S2)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)/C(=C\C3=CC(=CC=C3)Cl)/S2)CC(=O)O

InChI

InChI=1S/C17H12ClNO3S/c18-12-5-3-4-11(8-12)9-15-17(22)19(10-16(20)21)13-6-1-2-7-14(13)23-15/h1-9H,10H2,(H,20,21)/b15-9+