(2R,3S)-3-phenyl-4-piperidin-1-ium-1-yl-2-(4-propoxyphenyl)butan-2-ol

Systemtic Name: (2R,3S)-3-phenyl-4-piperidin-1-ium-1-yl-2-(4-propoxyphenyl)butan-2-ol Openeye Name: (2R,3S)-3-phenyl-4-piperidin-1-ium-1-yl-2-(4-propoxyphenyl)butan-2-ol CAS Name: (2R,3S)-3-phenyl-4-(1-piperidin-1-iumyl)-2-(4-propoxyphenyl)-2-butanol IUPAC Name: (2R,3S)-3-phenyl-4-piperidin-1-ium-1-yl-2-(4-propoxyphenyl)butan-2-ol Traditional Name: (2R,3S)-3-phenyl-4-piperidin-1-ium-1-yl-2-(4-propoxyphenyl)butan-2-ol Formula: C24H34NO2+ MolecularWeight: 368.53226

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C)(C(C[NH+]2CCCCC2)C3=CC=CC=C3)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@@](C)([C@H](C[NH+]2CCCCC2)C3=CC=CC=C3)O

InChI

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