N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-4-sulfamoyl-benzamide

Systemtic Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-4-sulfamoyl-benzamide Openeye Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-4-sulfamoyl-benzamide CAS Name: N-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]-4-sulfamoylbenzamide IUPAC Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-4-sulfamoylbenzamide Traditional Name: N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-4-sulfamoyl-benzamide Formula: C18H22N3O3S+ MolecularWeight: 360.45058

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H21N3O3S/c19-25(23,24)17-9-5-15(6-10-17)18(22)20-16-7-3-14(4-8-16)13-21-11-1-2-12-21/h3-10H,1-2,11-13H2,(H,20,22)(H2,19,23,24)/p+1