N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1-methyl-2-oxidanylidene-3H-indole-5-sulfonamide

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1-methyl-2-oxidanylidene-3H-indole-5-sulfonamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1-methyl-2-oxo-indoline-5-sulfonamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1-methyl-2-oxo-3H-indole-5-sulfonamide Traditional Name: 2-keto-1-methyl-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]indoline-5-sulfonamide Formula: C19H21N4O5S2+ MolecularWeight: 449.52384

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC2=C1C=CC(=C2)S(=O)(=O)NC3=CC(=CC=C3)S(=O)(=O)NC4=[NH+]CCC4

Isomeric SMILES

CN1C(=O)CC2=C1C=CC(=C2)S(=O)(=O)NC3=CC(=CC=C3)S(=O)(=O)NC4=[NH+]CCC4

InChI

InChI=1S/C19H20N4O5S2/c1-23-17-8-7-16(10-13(17)11-19(23)24)29(25,26)21-14-4-2-5-15(12-14)30(27,28)22-18-6-3-9-20-18/h2,4-5,7-8,10,12,21H,3,6,9,11H2,1H3,(H,20,22)/p+1