4-(carboxymethyl)-3-oxidanylidene-2-[(4-phenoxyphenyl)methyl]-1,4-benzothiazine-6-carboxylic acid

Systemtic Name: 4-(carboxymethyl)-3-oxidanylidene-2-[(4-phenoxyphenyl)methyl]-1,4-benzothiazine-6-carboxylic acid Openeye Name: 4-(carboxymethyl)-3-oxo-2-[(4-phenoxyphenyl)methyl]-1,4-benzothiazine-6-carboxylic acid CAS Name: 4-(carboxymethyl)-3-oxo-2-[(4-phenoxyphenyl)methyl]-1,4-benzothiazine-6-carboxylic acid IUPAC Name: 4-(carboxymethyl)-3-oxo-2-[(4-phenoxyphenyl)methyl]-1,4-benzothiazine-6-carboxylic acid Traditional Name: 4-(carboxymethyl)-3-keto-2-(4-phenoxybenzyl)-1,4-benzothiazine-6-carboxylic acid Formula: C24H19NO6S MolecularWeight: 449.47576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)CC3C(=O)N(C4=C(S3)C=CC(=C4)C(=O)O)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)CC3C(=O)N(C4=C(S3)C=CC(=C4)C(=O)O)CC(=O)O

InChI

InChI=1S/C24H19NO6S/c26-22(27)14-25-19-13-16(24(29)30)8-11-20(19)32-21(23(25)28)12-15-6-9-18(10-7-15)31-17-4-2-1-3-5-17/h1-11,13,21H,12,14H2,(H,26,27)(H,29,30)