2-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-ylcarbamoyl)benzoic acid

Systemtic Name: 2-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-ylcarbamoyl)benzoic acid Openeye Name: 2-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-ylcarbamoyl)benzoic acid CAS Name: 2-[(4,5-dihydrobenzo[e][1,3]benzothiazol-2-ylamino)-oxomethyl]benzoic acid IUPAC Name: 2-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-ylcarbamoyl)benzoic acid Traditional Name: 2-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-ylcarbamoyl)benzoic acid Formula: C19H14N2O3S MolecularWeight: 350.39106

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)N=C(S2)NC(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)N=C(S2)NC(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C19H14N2O3S/c22-17(13-7-3-4-8-14(13)18(23)24)21-19-20-16-12-6-2-1-5-11(12)9-10-15(16)25-19/h1-8H,9-10H2,(H,23,24)(H,20,21,22)