4-bromanyl-N-[(2R)-2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzamide

Systemtic Name: 4-bromanyl-N-[(2R)-2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzamide Openeye Name: 4-bromo-N-[(2R)-2-(5-methyl-2-furyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzamide CAS Name: 4-bromo-N-[(2R)-2-(5-methyl-2-furanyl)-2-(4-methyl-1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-bromo-N-[(2R)-2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzamide Traditional Name: 4-bromo-N-[(2R)-2-(5-methyl-2-furyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzamide Formula: C20H26BrN2O2+ MolecularWeight: 406.33664

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)C2=CC=C(C=C2)Br)C3=CC=C(O3)C

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](CNC(=O)C2=CC=C(C=C2)Br)C3=CC=C(O3)C

InChI

InChI=1S/C20H25BrN2O2/c1-14-9-11-23(12-10-14)18(19-8-3-15(2)25-19)13-22-20(24)16-4-6-17(21)7-5-16/h3-8,14,18H,9-13H2,1-2H3,(H,22,24)/p+1/t18-/m1/s1