N-(2-methoxyethyl)-3-[1-[(2R)-1-methylsulfanylpropan-2-yl]piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-(2-methoxyethyl)-3-[1-[(2R)-1-methylsulfanylpropan-2-yl]piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-(2-methoxyethyl)-3-[1-[(1R)-1-methyl-2-methylsulfanyl-ethyl]piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-(2-methoxyethyl)-3-[[1-[(2R)-1-(methylthio)propan-2-yl]-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-(2-methoxyethyl)-3-[1-[(2R)-1-methylsulfanylpropan-2-yl]piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-(2-methoxyethyl)-3-[1-[(1R)-1-methyl-2-(methylthio)ethyl]piperidin-1-ium-4-yl]oxy-benzamide Formula: C19H31N2O3S+ MolecularWeight: 367.52604

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC)[NH+]1CCC(CC1)OC2=CC=CC(=C2)C(=O)NCCOC

Isomeric SMILES

C[C@H](CSC)[NH+]1CCC(CC1)OC2=CC=CC(=C2)C(=O)NCCOC

InChI

InChI=1S/C19H30N2O3S/c1-15(14-25-3)21-10-7-17(8-11-21)24-18-6-4-5-16(13-18)19(22)20-9-12-23-2/h4-6,13,15,17H,7-12,14H2,1-3H3,(H,20,22)/p+1/t15-/m1/s1