(3R)-1-phenyl-5-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)pentan-3-ol

Systemtic Name: (3R)-1-phenyl-5-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)pentan-3-ol Openeye Name: (3R)-1-phenyl-5-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)pentan-3-ol CAS Name: (3R)-1-phenyl-5-(1-piperidin-1-iumyl)-3-(4-propoxyphenyl)-3-pentanol IUPAC Name: (3R)-1-phenyl-5-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)pentan-3-ol Traditional Name: (3R)-1-phenyl-5-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)pentan-3-ol Formula: C25H36NO2+ MolecularWeight: 382.55884

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(CCC2=CC=CC=C2)(CC[NH+]3CCCCC3)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@@](CCC2=CC=CC=C2)(CC[NH+]3CCCCC3)O

InChI

InChI=1S/C25H35NO2/c1-2-21-28-24-13-11-23(12-14-24)25(27,16-15-22-9-5-3-6-10-22)17-20-26-18-7-4-8-19-26/h3,5-6,9-14,27H,2,4,7-8,15-21H2,1H3/p+1/t25-/m1/s1