1-[3-[(2R)-3-(4-methylpiperidin-1-ium-1-yl)-2-oxidanyl-propoxy]phenyl]ethanone

Systemtic Name: 1-[3-[(2R)-3-(4-methylpiperidin-1-ium-1-yl)-2-oxidanyl-propoxy]phenyl]ethanone Openeye Name: 1-[3-[(2R)-2-hydroxy-3-(4-methylpiperidin-1-ium-1-yl)propoxy]phenyl]ethanone CAS Name: 1-[3-[(2R)-2-hydroxy-3-(4-methyl-1-piperidin-1-iumyl)propoxy]phenyl]ethanone IUPAC Name: 1-[3-[(2R)-2-hydroxy-3-(4-methylpiperidin-1-ium-1-yl)propoxy]phenyl]ethanone Traditional Name: 1-[3-[(2R)-2-hydroxy-3-(4-methylpiperidin-1-ium-1-yl)propoxy]phenyl]ethanone Formula: C17H26NO3+ MolecularWeight: 292.39324

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(COC2=CC=CC(=C2)C(=O)C)O

Isomeric SMILES

CC1CC[NH+](CC1)C[C@H](COC2=CC=CC(=C2)C(=O)C)O

InChI

InChI=1S/C17H25NO3/c1-13-6-8-18(9-7-13)11-16(20)12-21-17-5-3-4-15(10-17)14(2)19/h3-5,10,13,16,20H,6-9,11-12H2,1-2H3/p+1/t16-/m1/s1