2-[6-benzamido-1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanoic acid

Systemtic Name: 2-[6-benzamido-1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanoic acid Openeye Name: 2-(6-benzamido-1,1,3-trioxo-1,2-benzothiazol-2-yl)acetic acid CAS Name: 2-(6-benzamido-1,1,3-trioxo-1,2-benzothiazol-2-yl)acetic acid IUPAC Name: 2-(6-benzamido-1,1,3-trioxo-1,2-benzothiazol-2-yl)acetic acid Traditional Name: 2-(6-benzamido-1,1,3-triketo-1,2-benzothiazol-2-yl)acetic acid Formula: C16H12N2O6S MolecularWeight: 360.34128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(=O)N(S3(=O)=O)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(=O)N(S3(=O)=O)CC(=O)O

InChI

InChI=1S/C16H12N2O6S/c19-14(20)9-18-16(22)12-7-6-11(8-13(12)25(18,23)24)17-15(21)10-4-2-1-3-5-10/h1-8H,9H2,(H,17,21)(H,19,20)