(3S)-1-[(2-cyclopentyloxyphenyl)methyl]-N-methyl-N-(2-pyridin-2-ylethyl)piperidin-1-ium-3-amine

Systemtic Name: (3S)-1-[(2-cyclopentyloxyphenyl)methyl]-N-methyl-N-(2-pyridin-2-ylethyl)piperidin-1-ium-3-amine Openeye Name: (3S)-1-[[2-(cyclopentoxy)phenyl]methyl]-N-methyl-N-[2-(2-pyridyl)ethyl]piperidin-1-ium-3-amine CAS Name: (3S)-1-[(2-cyclopentyloxyphenyl)methyl]-N-methyl-N-[2-(2-pyridinyl)ethyl]-3-piperidin-1-iumamine IUPAC Name: (3S)-1-[(2-cyclopentyloxyphenyl)methyl]-N-methyl-N-(2-pyridin-2-ylethyl)piperidin-1-ium-3-amine Traditional Name: [(3S)-1-[2-(cyclopentoxy)benzyl]piperidin-1-ium-3-yl]-methyl-[2-(2-pyridyl)ethyl]amine Formula: C25H36N3O+ MolecularWeight: 394.57284

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C2CCC[NH+](C2)CC3=CC=CC=C3OC4CCCC4

Isomeric SMILES

CN(CCC1=CC=CC=N1)[C@H]2CCC[NH+](C2)CC3=CC=CC=C3OC4CCCC4

InChI

InChI=1S/C25H35N3O/c1-27(18-15-22-10-6-7-16-26-22)23-11-8-17-28(20-23)19-21-9-2-5-14-25(21)29-24-12-3-4-13-24/h2,5-7,9-10,14,16,23-24H,3-4,8,11-13,15,17-20H2,1H3/p+1/t23-/m0/s1