2-chloranyl-5-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]sulfamoyl]benzoic acid

Systemtic Name: 2-chloranyl-5-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]sulfamoyl]benzoic acid Openeye Name: 2-chloro-5-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]sulfamoyl]benzoic acid CAS Name: 2-chloro-5-[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]sulfamoyl]benzoic acid IUPAC Name: 2-chloro-5-[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]sulfamoyl]benzoic acid Traditional Name: 2-chloro-5-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]sulfamoyl]benzoic acid Formula: C18H15ClN2O6S MolecularWeight: 422.8395

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NS(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NS(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C18H15ClN2O6S/c19-14-6-5-11(8-13(14)17(22)23)28(26,27)21-16(18(24)25)7-10-9-20-15-4-2-1-3-12(10)15/h1-6,8-9,16,20-21H,7H2,(H,22,23)(H,24,25)