N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]-3-sulfamoyl-benzamide

Systemtic Name: N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]-3-sulfamoyl-benzamide Openeye Name: N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]-3-sulfamoyl-benzamide CAS Name: N-[[6-(1-pyrrolidinyl)-3-pyridin-1-iumyl]methyl]-3-sulfamoylbenzamide IUPAC Name: N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]-3-sulfamoylbenzamide Traditional Name: N-[(6-pyrrolidinopyridin-1-ium-3-yl)methyl]-3-sulfamoyl-benzamide Formula: C17H21N4O3S+ MolecularWeight: 361.43864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O3S/c18-25(23,24)15-5-3-4-14(10-15)17(22)20-12-13-6-7-16(19-11-13)21-8-1-2-9-21/h3-7,10-11H,1-2,8-9,12H2,(H,20,22)(H2,18,23,24)/p+1