[5-methyl-2-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]oxy-phenyl]-[(3R)-3-oxidanylpiperidin-1-yl]methanone

Systemtic Name: [5-methyl-2-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]oxy-phenyl]-[(3R)-3-oxidanylpiperidin-1-yl]methanone Openeye Name: [(3R)-3-hydroxy-1-piperidyl]-[5-methyl-2-[1-(4-pyridylmethyl)piperidin-1-ium-4-yl]oxy-phenyl]methanone CAS Name: [(3R)-3-hydroxy-1-piperidinyl]-[5-methyl-2-[[1-(pyridin-4-ylmethyl)-4-piperidin-1-iumyl]oxy]phenyl]methanone IUPAC Name: [(3R)-3-hydroxypiperidin-1-yl]-[5-methyl-2-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Traditional Name: [(3R)-3-hydroxypiperidino]-[5-methyl-2-[1-(4-pyridylmethyl)piperidin-1-ium-4-yl]oxy-phenyl]methanone Formula: C24H32N3O3+ MolecularWeight: 410.52918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2CC[NH+](CC2)CC3=CC=NC=C3)C(=O)N4CCCC(C4)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC2CC[NH+](CC2)CC3=CC=NC=C3)C(=O)N4CCC[C@H](C4)O

InChI

InChI=1S/C24H31N3O3/c1-18-4-5-23(22(15-18)24(29)27-12-2-3-20(28)17-27)30-21-8-13-26(14-9-21)16-19-6-10-25-11-7-19/h4-7,10-11,15,20-21,28H,2-3,8-9,12-14,16-17H2,1H3/p+1/t20-/m1/s1