(1S)-1-(4-methoxyphenyl)-1-phenyl-3-piperidin-1-ium-1-yl-propan-1-ol

Systemtic Name: (1S)-1-(4-methoxyphenyl)-1-phenyl-3-piperidin-1-ium-1-yl-propan-1-ol Openeye Name: (1S)-1-(4-methoxyphenyl)-1-phenyl-3-piperidin-1-ium-1-yl-propan-1-ol CAS Name: (1S)-1-(4-methoxyphenyl)-1-phenyl-3-(1-piperidin-1-iumyl)-1-propanol IUPAC Name: (1S)-1-(4-methoxyphenyl)-1-phenyl-3-piperidin-1-ium-1-ylpropan-1-ol Traditional Name: (1S)-1-(4-methoxyphenyl)-1-phenyl-3-piperidin-1-ium-1-yl-propan-1-ol Formula: C21H28NO2+ MolecularWeight: 326.45252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC[NH+]2CCCCC2)(C3=CC=CC=C3)O

Isomeric SMILES

COC1=CC=C(C=C1)[C@](CC[NH+]2CCCCC2)(C3=CC=CC=C3)O

InChI

InChI=1S/C21H27NO2/c1-24-20-12-10-19(11-13-20)21(23,18-8-4-2-5-9-18)14-17-22-15-6-3-7-16-22/h2,4-5,8-13,23H,3,6-7,14-17H2,1H3/p+1/t21-/m0/s1