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

Systemtic Name: 1-[3-methoxy-4-[(2R)-3-(4-methylpiperidin-1-ium-1-yl)-2-oxidanyl-propoxy]phenyl]ethanone Openeye Name: 1-[4-[(2R)-2-hydroxy-3-(4-methylpiperidin-1-ium-1-yl)propoxy]-3-methoxy-phenyl]ethanone CAS Name: 1-[4-[(2R)-2-hydroxy-3-(4-methyl-1-piperidin-1-iumyl)propoxy]-3-methoxyphenyl]ethanone IUPAC Name: 1-[4-[(2R)-2-hydroxy-3-(4-methylpiperidin-1-ium-1-yl)propoxy]-3-methoxyphenyl]ethanone Traditional Name: 1-[4-[(2R)-2-hydroxy-3-(4-methylpiperidin-1-ium-1-yl)propoxy]-3-methoxy-phenyl]ethanone Formula: C18H28NO4+ MolecularWeight: 322.41922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO4/c1-13-6-8-19(9-7-13)11-16(21)12-23-17-5-4-15(14(2)20)10-18(17)22-3/h4-5,10,13,16,21H,6-9,11-12H2,1-3H3/p+1/t16-/m1/s1