(1S)-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]cyclohex-3-ene-1-carboxamide

Systemtic Name: (1S)-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]cyclohex-3-ene-1-carboxamide Openeye Name: (1S)-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]cyclohex-3-ene-1-carboxamide CAS Name: (1S)-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-1-cyclohex-3-enecarboxamide IUPAC Name: (1S)-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]cyclohex-3-ene-1-carboxamide Traditional Name: (1S)-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]cyclohex-3-ene-1-carboxamide Formula: C17H22N3O3S+ MolecularWeight: 348.43988

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCC=CC3

Isomeric SMILES

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)[C@H]3CCC=CC3

InChI

InChI=1S/C17H21N3O3S/c21-17(13-6-2-1-3-7-13)19-14-8-4-9-15(12-14)24(22,23)20-16-10-5-11-18-16/h1-2,4,8-9,12-13H,3,5-7,10-11H2,(H,18,20)(H,19,21)/p+1/t13-/m1/s1