5-bromanyl-N-[(2R)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-piperidin-1-ium-1-yl-ethyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(2R)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-piperidin-1-ium-1-yl-ethyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[(2R)-2-(1-methylindolin-5-yl)-2-piperidin-1-ium-1-yl-ethyl]furan-2-carboxamide CAS Name: 5-bromo-N-[(2R)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-(1-piperidin-1-iumyl)ethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(2R)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-piperidin-1-ium-1-ylethyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(2R)-2-(1-methylindolin-5-yl)-2-piperidin-1-ium-1-yl-ethyl]-2-furamide Formula: C21H27BrN3O2+ MolecularWeight: 433.36198

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C1C=CC(=C2)C(CNC(=O)C3=CC=C(O3)Br)[NH+]4CCCCC4

Isomeric SMILES

CN1CCC2=C1C=CC(=C2)[C@H](CNC(=O)C3=CC=C(O3)Br)[NH+]4CCCCC4

InChI

InChI=1S/C21H26BrN3O2/c1-24-12-9-16-13-15(5-6-17(16)24)18(25-10-3-2-4-11-25)14-23-21(26)19-7-8-20(22)27-19/h5-8,13,18H,2-4,9-12,14H2,1H3,(H,23,26)/p+1/t18-/m0/s1