1-(3-chlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide

Systemtic Name: 1-(3-chlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide Openeye Name: 1-(3-chlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide CAS Name: 1-(3-chlorophenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-5-benzimidazolecarboxamide IUPAC Name: 1-(3-chlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide Traditional Name: 1-(3-chlorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide Formula: C20H22ClN4O2+ MolecularWeight: 385.86728

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=CC3=C(C=C2)N(C=N3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=CC3=C(C=C2)N(C=N3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H21ClN4O2/c21-16-2-1-3-17(13-16)25-14-23-18-12-15(4-5-19(18)25)20(26)22-6-7-24-8-10-27-11-9-24/h1-5,12-14H,6-11H2,(H,22,26)/p+1