(3R)-5-methyl-1-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)hexan-3-ol

Systemtic Name: (3R)-5-methyl-1-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)hexan-3-ol Openeye Name: (3R)-5-methyl-1-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)hexan-3-ol CAS Name: (3R)-5-methyl-1-(1-piperidin-1-iumyl)-3-(4-propoxyphenyl)-3-hexanol IUPAC Name: (3R)-5-methyl-1-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)hexan-3-ol Traditional Name: (3R)-5-methyl-1-piperidin-1-ium-1-yl-3-(4-propoxyphenyl)hexan-3-ol Formula: C21H36NO2+ MolecularWeight: 334.51604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H35NO2/c1-4-16-24-20-10-8-19(9-11-20)21(23,17-18(2)3)12-15-22-13-6-5-7-14-22/h8-11,18,23H,4-7,12-17H2,1-3H3/p+1/t21-/m0/s1