(2S,3S)-3-(4-methoxyphenyl)-4-methyl-2-phenyl-1-piperidin-1-ium-1-yl-pentan-3-ol

Systemtic Name: (2S,3S)-3-(4-methoxyphenyl)-4-methyl-2-phenyl-1-piperidin-1-ium-1-yl-pentan-3-ol Openeye Name: (2S,3S)-3-(4-methoxyphenyl)-4-methyl-2-phenyl-1-piperidin-1-ium-1-yl-pentan-3-ol CAS Name: (2S,3S)-3-(4-methoxyphenyl)-4-methyl-2-phenyl-1-(1-piperidin-1-iumyl)-3-pentanol IUPAC Name: (2S,3S)-3-(4-methoxyphenyl)-4-methyl-2-phenyl-1-piperidin-1-ium-1-ylpentan-3-ol Traditional Name: (2S,3S)-3-(4-methoxyphenyl)-4-methyl-2-phenyl-1-piperidin-1-ium-1-yl-pentan-3-ol Formula: C24H34NO2+ MolecularWeight: 368.53226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)OC)(C(C[NH+]2CCCCC2)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)[C@@](C1=CC=C(C=C1)OC)([C@H](C[NH+]2CCCCC2)C3=CC=CC=C3)O

InChI

InChI=1S/C24H33NO2/c1-19(2)24(26,21-12-14-22(27-3)15-13-21)23(20-10-6-4-7-11-20)18-25-16-8-5-9-17-25/h4,6-7,10-15,19,23,26H,5,8-9,16-18H2,1-3H3/p+1/t23-,24-/m1/s1