1-(3-chlorophenyl)-5-propan-2-yl-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]pyrazole-4-carboxamide

Systemtic Name: 1-(3-chlorophenyl)-5-propan-2-yl-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]pyrazole-4-carboxamide Openeye Name: 1-(3-chlorophenyl)-5-isopropyl-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]pyrazole-4-carboxamide CAS Name: 1-(3-chlorophenyl)-5-propan-2-yl-N-[[6-(1-pyrrolidinyl)-3-pyridin-1-iumyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 1-(3-chlorophenyl)-5-propan-2-yl-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]pyrazole-4-carboxamide Traditional Name: 1-(3-chlorophenyl)-5-isopropyl-N-[(6-pyrrolidinopyridin-1-ium-3-yl)methyl]pyrazole-4-carboxamide Formula: C23H27ClN5O+ MolecularWeight: 424.94638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NCC3=C[NH+]=C(C=C3)N4CCCC4

Isomeric SMILES

CC(C)C1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NCC3=C[NH+]=C(C=C3)N4CCCC4

InChI

InChI=1S/C23H26ClN5O/c1-16(2)22-20(15-27-29(22)19-7-5-6-18(24)12-19)23(30)26-14-17-8-9-21(25-13-17)28-10-3-4-11-28/h5-9,12-13,15-16H,3-4,10-11,14H2,1-2H3,(H,26,30)/p+1