2-[(4-chloranyl-3-sulfamoyl-phenyl)carbonylamino]-1,3-dihydroisoindole-1-carboxylic acid

Systemtic Name: 2-[(4-chloranyl-3-sulfamoyl-phenyl)carbonylamino]-1,3-dihydroisoindole-1-carboxylic acid Openeye Name: 2-[(4-chloro-3-sulfamoyl-benzoyl)amino]isoindoline-1-carboxylic acid CAS Name: 2-[[(4-chloro-3-sulfamoylphenyl)-oxomethyl]amino]-1,3-dihydroisoindole-1-carboxylic acid IUPAC Name: 2-[(4-chloro-3-sulfamoylbenzoyl)amino]-1,3-dihydroisoindole-1-carboxylic acid Traditional Name: 2-[(4-chloro-3-sulfamoyl-benzoyl)amino]isoindoline-1-carboxylic acid Formula: C16H14ClN3O5S MolecularWeight: 395.81746

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(N1NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N)C(=O)O

Isomeric SMILES

C1C2=CC=CC=C2C(N1NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C16H14ClN3O5S/c17-12-6-5-9(7-13(12)26(18,24)25)15(21)19-20-8-10-3-1-2-4-11(10)14(20)16(22)23/h1-7,14H,8H2,(H,19,21)(H,22,23)(H2,18,24,25)