5-bromanyl-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]furan-2-carboxamide Openeye Name: 5-bromo-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]furan-2-carboxamide CAS Name: 5-bromo-N-[1-[2-(1-piperidin-1-iumyl)ethyl]-2-benzimidazolyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]furan-2-carboxamide Traditional Name: 5-bromo-N-[1-(2-piperidin-1-ium-1-ylethyl)benzimidazol-2-yl]-2-furamide Formula: C19H22BrN4O2+ MolecularWeight: 418.30758

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN2C3=CC=CC=C3N=C2NC(=O)C4=CC=C(O4)Br

Isomeric SMILES

C1CC[NH+](CC1)CCN2C3=CC=CC=C3N=C2NC(=O)C4=CC=C(O4)Br

InChI

InChI=1S/C19H21BrN4O2/c20-17-9-8-16(26-17)18(25)22-19-21-14-6-2-3-7-15(14)24(19)13-12-23-10-4-1-5-11-23/h2-3,6-9H,1,4-5,10-13H2,(H,21,22,25)/p+1