4-methoxy-3-[(5-sulfamoyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid

Systemtic Name: 4-methoxy-3-[(5-sulfamoyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid Openeye Name: 4-methoxy-3-(5-sulfamoylindolin-1-yl)sulfonyl-benzoic acid CAS Name: 4-methoxy-3-[(5-sulfamoyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid IUPAC Name: 4-methoxy-3-[(5-sulfamoyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid Traditional Name: 4-methoxy-3-(5-sulfamoylindolin-1-yl)sulfonyl-benzoic acid Formula: C16H16N2O7S2 MolecularWeight: 412.43744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N

InChI

InChI=1S/C16H16N2O7S2/c1-25-14-5-2-11(16(19)20)9-15(14)27(23,24)18-7-6-10-8-12(26(17,21)22)3-4-13(10)18/h2-5,8-9H,6-7H2,1H3,(H,19,20)(H2,17,21,22)