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

Systemtic Name: 2-(1-methyl-1-prop-2-enyl-pyrrolidin-1-ium-2-yl)-1,3-diphenyl-propan-2-ol iodide Openeye Name: 2-(1-allyl-1-methyl-pyrrolidin-1-ium-2-yl)-1,3-diphenyl-propan-2-ol iodide CAS Name: 2-(1-methyl-1-prop-2-enyl-2-pyrrolidin-1-iumyl)-1,3-diphenyl-2-propanol iodide IUPAC Name: 2-(1-methyl-1-prop-2-enylpyrrolidin-1-ium-2-yl)-1,3-diphenylpropan-2-ol iodide Traditional Name: 2-(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(CC2=CC=CC=C2)(CC3=CC=CC=C3)O)CC=C.[I-]

Isomeric SMILES

C[N+]1(CCCC1C(CC2=CC=CC=C2)(CC3=CC=CC=C3)O)CC=C.[I-]

InChI

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