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

Systemtic Name: (1S)-1-(4-methoxyphenyl)-3-piperidin-1-ium-1-yl-1-(4-propoxyphenyl)propan-1-ol Openeye Name: (1S)-1-(4-methoxyphenyl)-3-piperidin-1-ium-1-yl-1-(4-propoxyphenyl)propan-1-ol CAS Name: (1S)-1-(4-methoxyphenyl)-3-(1-piperidin-1-iumyl)-1-(4-propoxyphenyl)-1-propanol IUPAC Name: (1S)-1-(4-methoxyphenyl)-3-piperidin-1-ium-1-yl-1-(4-propoxyphenyl)propan-1-ol Traditional Name: (1S)-1-(4-methoxyphenyl)-3-piperidin-1-ium-1-yl-1-(4-propoxyphenyl)propan-1-ol Formula: C24H34NO3+ MolecularWeight: 384.53166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H33NO3/c1-3-19-28-23-13-9-21(10-14-23)24(26,15-18-25-16-5-4-6-17-25)20-7-11-22(27-2)12-8-20/h7-14,26H,3-6,15-19H2,1-2H3/p+1/t24-/m0/s1