4-bromanyl-3,5-dimethoxy-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]benzamide

Systemtic Name: 4-bromanyl-3,5-dimethoxy-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]benzamide Openeye Name: 4-bromo-3,5-dimethoxy-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]benzamide CAS Name: 4-bromo-3,5-dimethoxy-N-[(2S)-2-(4-methyl-1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 4-bromo-3,5-dimethoxy-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-ylethyl]benzamide Traditional Name: 4-bromo-3,5-dimethoxy-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]benzamide Formula: C21H28BrN2O3S+ MolecularWeight: 468.42762

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)C2=CC(=C(C(=C2)OC)Br)OC)C3=CC=CS3

Isomeric SMILES

CC1CC[NH+](CC1)[C@@H](CNC(=O)C2=CC(=C(C(=C2)OC)Br)OC)C3=CC=CS3

InChI

InChI=1S/C21H27BrN2O3S/c1-14-6-8-24(9-7-14)16(19-5-4-10-28-19)13-23-21(25)15-11-17(26-2)20(22)18(12-15)27-3/h4-5,10-12,14,16H,6-9,13H2,1-3H3,(H,23,25)/p+1/t16-/m0/s1