N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-1-methyl-4-(1-pyrrolidinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-1-methyl-4-pyrrolidin-1-ylsulfonylpyrrole-2-carboxamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-1-methyl-4-pyrrolidinosulfonyl-pyrrole-2-carboxamide Formula: C22H30ClN4O3S+ MolecularWeight: 466.0166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)S(=O)(=O)N4CCCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H29ClN4O3S/c1-25-16-20(31(29,30)27-10-2-3-11-27)14-21(25)22(28)24-19-8-12-26(13-9-19)15-17-4-6-18(23)7-5-17/h4-7,14,16,19H,2-3,8-13,15H2,1H3,(H,24,28)/p+1