3-(benzo[e][1,3]benzothiazol-2-ylsulfamoyl)-4-methoxy-benzoic acid

Systemtic Name: 3-(benzo[e][1,3]benzothiazol-2-ylsulfamoyl)-4-methoxy-benzoic acid Openeye Name: 3-(benzo[e][1,3]benzothiazol-2-ylsulfamoyl)-4-methoxy-benzoic acid CAS Name: 3-(2-benzo[e][1,3]benzothiazolylsulfamoyl)-4-methoxybenzoic acid IUPAC Name: 3-(benzo[e][1,3]benzothiazol-2-ylsulfamoyl)-4-methoxybenzoic acid Traditional Name: 3-(benzo[e][1,3]benzothiazol-2-ylsulfamoyl)-4-methoxy-benzoic acid Formula: C19H14N2O5S2 MolecularWeight: 414.45486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43

InChI

InChI=1S/C19H14N2O5S2/c1-26-14-8-6-12(18(22)23)10-16(14)28(24,25)21-19-20-17-13-5-3-2-4-11(13)7-9-15(17)27-19/h2-10H,1H3,(H,20,21)(H,22,23)