3,5-dimethoxy-N-[[(3R)-1-(3-methylsulfanylpropyl)piperidin-1-ium-3-yl]methyl]benzamide

Systemtic Name: 3,5-dimethoxy-N-[[(3R)-1-(3-methylsulfanylpropyl)piperidin-1-ium-3-yl]methyl]benzamide Openeye Name: 3,5-dimethoxy-N-[[(3R)-1-(3-methylsulfanylpropyl)piperidin-1-ium-3-yl]methyl]benzamide CAS Name: 3,5-dimethoxy-N-[[(3R)-1-[3-(methylthio)propyl]-3-piperidin-1-iumyl]methyl]benzamide IUPAC Name: 3,5-dimethoxy-N-[[(3R)-1-(3-methylsulfanylpropyl)piperidin-1-ium-3-yl]methyl]benzamide Traditional Name: 3,5-dimethoxy-N-[[(3R)-1-[3-(methylthio)propyl]piperidin-1-ium-3-yl]methyl]benzamide Formula: C19H31N2O3S+ MolecularWeight: 367.52604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCC2CCC[NH+](C2)CCCSC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NC[C@H]2CCC[NH+](C2)CCCSC)OC

InChI

InChI=1S/C19H30N2O3S/c1-23-17-10-16(11-18(12-17)24-2)19(22)20-13-15-6-4-7-21(14-15)8-5-9-25-3/h10-12,15H,4-9,13-14H2,1-3H3,(H,20,22)/p+1/t15-/m1/s1