2-pyrrolidin-1-yl-N-[2-(4-sulfamoylphenyl)ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 2-pyrrolidin-1-yl-N-[2-(4-sulfamoylphenyl)ethyl]pyridin-1-ium-3-carboxamide Openeye Name: 2-pyrrolidin-1-yl-N-[2-(4-sulfamoylphenyl)ethyl]pyridin-1-ium-3-carboxamide CAS Name: 2-(1-pyrrolidinyl)-N-[2-(4-sulfamoylphenyl)ethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 2-pyrrolidin-1-yl-N-[2-(4-sulfamoylphenyl)ethyl]pyridin-1-ium-3-carboxamide Traditional Name: 2-pyrrolidino-N-[2-(4-sulfamoylphenyl)ethyl]pyridin-1-ium-3-carboxamide Formula: C18H23N4O3S+ MolecularWeight: 375.46522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=[NH+]2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=[NH+]2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H22N4O3S/c19-26(24,25)15-7-5-14(6-8-15)9-11-21-18(23)16-4-3-10-20-17(16)22-12-1-2-13-22/h3-8,10H,1-2,9,11-13H2,(H,21,23)(H2,19,24,25)/p+1