4-[(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)amino]benzoic acid

Systemtic Name: 4-[(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)amino]benzoic acid Openeye Name: 4-[(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)amino]benzoic acid CAS Name: 4-[(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)amino]benzoic acid IUPAC Name: 4-[(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)amino]benzoic acid Traditional Name: 4-[(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)amino]benzoic acid Formula: C19H16N2O3S MolecularWeight: 352.40694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3=C(CC2)SC(=N3)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)C3=C(CC2)SC(=N3)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C19H16N2O3S/c1-24-14-7-8-15-12(10-14)4-9-16-17(15)21-19(25-16)20-13-5-2-11(3-6-13)18(22)23/h2-3,5-8,10H,4,9H2,1H3,(H,20,21)(H,22,23)