1-(1-methyl-1-prop-2-enyl-pyrrolidin-1-ium-2-yl)-1,3-diphenyl-propan-2-ol iodide

Systemtic Name: 1-(1-methyl-1-prop-2-enyl-pyrrolidin-1-ium-2-yl)-1,3-diphenyl-propan-2-ol iodide Openeye Name: 1-(1-allyl-1-methyl-pyrrolidin-1-ium-2-yl)-1,3-diphenyl-propan-2-ol iodide CAS Name: 1-(1-methyl-1-prop-2-enyl-2-pyrrolidin-1-iumyl)-1,3-diphenyl-2-propanol iodide IUPAC Name: 1-(1-methyl-1-prop-2-enylpyrrolidin-1-ium-2-yl)-1,3-diphenylpropan-2-ol iodide Traditional Name: 1-(1-allyl-1-methyl-pyrrolidin-1-ium-2-yl)-1,3-diphenyl-propan-2-ol iodide Formula: C23H30INO MolecularWeight: 463.39487

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1C(C2=CC=CC=C2)C(CC3=CC=CC=C3)O)CC=C.[I-]

Isomeric SMILES

C[N+]1(CCCC1C(C2=CC=CC=C2)C(CC3=CC=CC=C3)O)CC=C.[I-]

InChI

InChI=1S/C23H30NO.HI/c1-3-16-24(2)17-10-15-21(24)23(20-13-8-5-9-14-20)22(25)18-19-11-6-4-7-12-19;/h3-9,11-14,21-23,25H,1,10,15-18H2,2H3;1H/q+1;/p-1