1-[3,4-bis(fluoranyl)phenyl]-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide Openeye Name: 1-(3,4-difluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide CAS Name: 1-(3,4-difluorophenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-5-benzimidazolecarboxamide IUPAC Name: 1-(3,4-difluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide Traditional Name: 1-(3,4-difluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)benzimidazole-5-carboxamide Formula: C20H21F2N4O2+ MolecularWeight: 387.403146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20F2N4O2/c21-16-3-2-15(12-17(16)22)26-13-24-18-11-14(1-4-19(18)26)20(27)23-5-6-25-7-9-28-10-8-25/h1-4,11-13H,5-10H2,(H,23,27)/p+1