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

Systemtic Name: (1R,2S)-1-(2-methoxyphenyl)-2-phenyl-3-piperidin-1-ium-1-yl-1-(4-propoxyphenyl)propan-1-ol Openeye Name: (1R,2S)-1-(2-methoxyphenyl)-2-phenyl-3-piperidin-1-ium-1-yl-1-(4-propoxyphenyl)propan-1-ol CAS Name: (1R,2S)-1-(2-methoxyphenyl)-2-phenyl-3-(1-piperidin-1-iumyl)-1-(4-propoxyphenyl)-1-propanol IUPAC Name: (1R,2S)-1-(2-methoxyphenyl)-2-phenyl-3-piperidin-1-ium-1-yl-1-(4-propoxyphenyl)propan-1-ol Traditional Name: (1R,2S)-1-(2-methoxyphenyl)-2-phenyl-3-piperidin-1-ium-1-yl-1-(4-propoxyphenyl)propan-1-ol Formula: C30H38NO3+ MolecularWeight: 460.62762

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C2=CC=CC=C2OC)(C(C[NH+]3CCCCC3)C4=CC=CC=C4)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@@](C2=CC=CC=C2OC)([C@H](C[NH+]3CCCCC3)C4=CC=CC=C4)O

InChI

InChI=1S/C30H37NO3/c1-3-22-34-26-18-16-25(17-19-26)30(32,27-14-8-9-15-29(27)33-2)28(24-12-6-4-7-13-24)23-31-20-10-5-11-21-31/h4,6-9,12-19,28,32H,3,5,10-11,20-23H2,1-2H3/p+1/t28-,30-/m1/s1