4-chloranyl-N-[3-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-3-ium-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[3-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-3-ium-2-yl]benzamide Openeye Name: 4-chloro-N-[3-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-3-ium-2-yl]benzamide CAS Name: 4-chloro-N-[3-[2-(1-pyrrolidinyl)ethyl]-1H-benzimidazol-3-ium-2-yl]benzamide IUPAC Name: 4-chloro-N-[3-(2-pyrrolidin-1-ylethyl)-1H-benzimidazol-3-ium-2-yl]benzamide Traditional Name: 4-chloro-N-[3-(2-pyrrolidinoethyl)-1H-benzimidazol-3-ium-2-yl]benzamide Formula: C20H22ClN4O+ MolecularWeight: 369.86788

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC[N+]2=C(NC3=CC=CC=C32)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)CC[N+]2=C(NC3=CC=CC=C32)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H21ClN4O/c21-16-9-7-15(8-10-16)19(26)23-20-22-17-5-1-2-6-18(17)25(20)14-13-24-11-3-4-12-24/h1-2,5-10H,3-4,11-14H2,(H,22,23,26)/p+1