4-[(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)methyl]benzoic acid

Systemtic Name: 4-[(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)methyl]benzoic acid Openeye Name: 4-[(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzoic acid CAS Name: 4-[(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzoic acid IUPAC Name: 4-[(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzoic acid Traditional Name: 4-[(3-keto-4H-1,4-benzothiazin-2-ylidene)methyl]benzoic acid Formula: C16H11NO3S MolecularWeight: 297.32844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(=CC3=CC=C(C=C3)C(=O)O)S2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(=CC3=CC=C(C=C3)C(=O)O)S2

InChI

InChI=1S/C16H11NO3S/c18-15-14(21-13-4-2-1-3-12(13)17-15)9-10-5-7-11(8-6-10)16(19)20/h1-9H,(H,17,18)(H,19,20)