4-(1-methylpyrrolidin-1-ium-1-yl)-1-(2-phenylphenyl)butan-1-ol iodide

Systemtic Name: 4-(1-methylpyrrolidin-1-ium-1-yl)-1-(2-phenylphenyl)butan-1-ol iodide Openeye Name: 4-(1-methylpyrrolidin-1-ium-1-yl)-1-(2-phenylphenyl)butan-1-ol iodide CAS Name: 4-(1-methyl-1-pyrrolidin-1-iumyl)-1-(2-phenylphenyl)-1-butanol iodide IUPAC Name: 4-(1-methylpyrrolidin-1-ium-1-yl)-1-(2-phenylphenyl)butan-1-ol iodide Traditional Name: 4-(1-methylpyrrolidin-1-ium-1-yl)-1-(2-phenylphenyl)butan-1-ol iodide Formula: C21H28INO MolecularWeight: 437.35759

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1)CCCC(C2=CC=CC=C2C3=CC=CC=C3)O.[I-]

Isomeric SMILES

C[N+]1(CCCC1)CCCC(C2=CC=CC=C2C3=CC=CC=C3)O.[I-]

InChI

InChI=1S/C21H28NO.HI/c1-22(15-7-8-16-22)17-9-14-21(23)20-13-6-5-12-19(20)18-10-3-2-4-11-18;/h2-6,10-13,21,23H,7-9,14-17H2,1H3;1H/q+1;/p-1