3-bromanyl-N-[(2R)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[(2R)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 3-bromo-N-[(2R)-2-(1-methylindolin-5-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 3-bromo-N-[(2R)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 3-bromo-N-[(2R)-2-(1-methyl-2,3-dihydroindol-5-yl)-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 3-bromo-N-[(2R)-2-(1-methylindolin-5-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C22H27BrN3O+ MolecularWeight: 429.37328

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C1C=CC(=C2)C(CNC(=O)C3=CC(=CC=C3)Br)[NH+]4CCCC4

Isomeric SMILES

CN1CCC2=C1C=CC(=C2)[C@H](CNC(=O)C3=CC(=CC=C3)Br)[NH+]4CCCC4

InChI

InChI=1S/C22H26BrN3O/c1-25-12-9-17-13-16(7-8-20(17)25)21(26-10-2-3-11-26)15-24-22(27)18-5-4-6-19(23)14-18/h4-8,13-14,21H,2-3,9-12,15H2,1H3,(H,24,27)/p+1/t21-/m0/s1