5-[2-(2,4-dichlorophenyl)ethoxy]-1-oxidanidyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 5-[2-(2,4-dichlorophenyl)ethoxy]-1-oxidanidyl-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridin-1-ium-3-carboxamide Openeye Name: 5-[2-(2,4-dichlorophenyl)ethoxy]-1-oxido-N-[[1-(4-pyridyl)-4-piperidyl]methyl]pyridin-1-ium-3-carboxamide CAS Name: 5-[2-(2,4-dichlorophenyl)ethoxy]-1-oxido-N-[(1-pyridin-4-yl-4-piperidinyl)methyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 5-[2-(2,4-dichlorophenyl)ethoxy]-1-oxido-N-[(1-pyridin-4-ylpiperidin-4-yl)methyl]pyridin-1-ium-3-carboxamide Traditional Name: 5-[2-(2,4-dichlorophenyl)ethoxy]-1-oxido-N-[[1-(4-pyridyl)-4-piperidyl]methyl]pyridin-1-ium-3-carboxamide Formula: C25H26Cl2N4O3 MolecularWeight: 501.40494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C2=CC(=C[N+](=C2)[O-])OCCC3=C(C=C(C=C3)Cl)Cl)C4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1CNC(=O)C2=CC(=C[N+](=C2)[O-])OCCC3=C(C=C(C=C3)Cl)Cl)C4=CC=NC=C4

InChI

InChI=1S/C25H26Cl2N4O3/c26-21-2-1-19(24(27)14-21)7-12-34-23-13-20(16-31(33)17-23)25(32)29-15-18-5-10-30(11-6-18)22-3-8-28-9-4-22/h1-4,8-9,13-14,16-18H,5-7,10-12,15H2,(H,29,32)