[(3S)-3-methoxypiperidin-1-yl]-[2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone

Systemtic Name: [(3S)-3-methoxypiperidin-1-yl]-[2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Openeye Name: [(3S)-3-methoxy-1-piperidyl]-[2-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone CAS Name: [(3S)-3-methoxy-1-piperidinyl]-[2-[[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]oxy]phenyl]methanone IUPAC Name: [(3S)-3-methoxypiperidin-1-yl]-[2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Traditional Name: [(3S)-3-methoxypiperidino]-[2-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxyphenyl]methanone Formula: C24H32N3O3+ MolecularWeight: 410.52918

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCCN(C1)C(=O)C2=CC=CC=C2OC3CC[NH+](CC3)CC4=CC=CC=N4

Isomeric SMILES

CO[C@H]1CCCN(C1)C(=O)C2=CC=CC=C2OC3CC[NH+](CC3)CC4=CC=CC=N4

InChI

InChI=1S/C24H31N3O3/c1-29-21-8-6-14-27(18-21)24(28)22-9-2-3-10-23(22)30-20-11-15-26(16-12-20)17-19-7-4-5-13-25-19/h2-5,7,9-10,13,20-21H,6,8,11-12,14-18H2,1H3/p+1/t21-/m0/s1