2-(2-azanyl-2-oxidanylidene-ethoxy)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]benzamide

Systemtic Name: 2-(2-azanyl-2-oxidanylidene-ethoxy)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]benzamide Openeye Name: 2-(2-amino-2-oxo-ethoxy)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]benzamide CAS Name: 2-(2-amino-2-oxoethoxy)-N-[(2R)-2-(4-methyl-1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 2-(2-amino-2-oxoethoxy)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-ylethyl]benzamide Traditional Name: 2-(2-amino-2-keto-ethoxy)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]benzamide Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)C2=CC=CC=C2OCC(=O)N)C3=CC=CS3

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](CNC(=O)C2=CC=CC=C2OCC(=O)N)C3=CC=CS3

InChI

InChI=1S/C21H27N3O3S/c1-15-8-10-24(11-9-15)17(19-7-4-12-28-19)13-23-21(26)16-5-2-3-6-18(16)27-14-20(22)25/h2-7,12,15,17H,8-11,13-14H2,1H3,(H2,22,25)(H,23,26)/p+1/t17-/m1/s1