(3,4-dichlorophenyl)methyl 1-(1H-benzimidazol-2-ylamino)-4-(2-ethoxyethyl)piperidin-1-ium-1-carboxylate

Systemtic Name: (3,4-dichlorophenyl)methyl 1-(1H-benzimidazol-2-ylamino)-4-(2-ethoxyethyl)piperidin-1-ium-1-carboxylate Openeye Name: (3,4-dichlorophenyl)methyl 1-(1H-benzimidazol-2-ylamino)-4-(2-ethoxyethyl)piperidin-1-ium-1-carboxylate CAS Name: 1-(1H-benzimidazol-2-ylamino)-4-(2-ethoxyethyl)-1-piperidin-1-iumcarboxylic acid (3,4-dichlorophenyl)methyl ester IUPAC Name: (3,4-dichlorophenyl)methyl 1-(1H-benzimidazol-2-ylamino)-4-(2-ethoxyethyl)piperidin-1-ium-1-carboxylate Traditional Name: 1-(1H-benzimidazol-2-ylamino)-4-(2-ethoxyethyl)piperidin-1-ium-1-carboxylic acid (3,4-dichlorobenzyl) ester Formula: C24H29Cl2N4O3+ MolecularWeight: 492.41806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCC1CC[N+](CC1)(C(=O)OCC2=CC(=C(C=C2)Cl)Cl)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCOCCC1CC[N+](CC1)(C(=O)OCC2=CC(=C(C=C2)Cl)Cl)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C24H29Cl2N4O3/c1-2-32-14-11-17-9-12-30(13-10-17,29-23-27-21-5-3-4-6-22(21)28-23)24(31)33-16-18-7-8-19(25)20(26)15-18/h3-8,15,17H,2,9-14,16H2,1H3,(H2,27,28,29)/q+1