[(3S)-1-[1-(2-methoxyphenyl)piperidin-4-yl]-3-(phenylmethyl)piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-1-[1-(2-methoxyphenyl)piperidin-4-yl]-3-(phenylmethyl)piperidin-1-ium-3-yl]methanol Openeye Name: [(3S)-3-benzyl-1-[1-(2-methoxyphenyl)-4-piperidyl]piperidin-1-ium-3-yl]methanol CAS Name: [(3S)-1-[1-(2-methoxyphenyl)-4-piperidinyl]-3-(phenylmethyl)-3-piperidin-1-iumyl]methanol IUPAC Name: [(3S)-3-benzyl-1-[1-(2-methoxyphenyl)piperidin-4-yl]piperidin-1-ium-3-yl]methanol Traditional Name: [(3S)-3-benzyl-1-[1-(2-methoxyphenyl)-4-piperidyl]piperidin-1-ium-3-yl]methanol Formula: C25H35N2O2+ MolecularWeight: 395.5576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCC(CC2)[NH+]3CCCC(C3)(CC4=CC=CC=C4)CO

Isomeric SMILES

COC1=CC=CC=C1N2CCC(CC2)[NH+]3CCC[C@@](C3)(CC4=CC=CC=C4)CO

InChI

InChI=1S/C25H34N2O2/c1-29-24-11-6-5-10-23(24)26-16-12-22(13-17-26)27-15-7-14-25(19-27,20-28)18-21-8-3-2-4-9-21/h2-6,8-11,22,28H,7,12-20H2,1H3/p+1/t25-/m0/s1