dimethyl-[4-oxidanyl-4-(2-phenylphenyl)butyl]-propan-2-yl-azanium iodide

Systemtic Name: dimethyl-[4-oxidanyl-4-(2-phenylphenyl)butyl]-propan-2-yl-azanium iodide Openeye Name: [4-hydroxy-4-(2-phenylphenyl)butyl]-isopropyl-dimethyl-ammonium iodide CAS Name: [4-hydroxy-4-(2-phenylphenyl)butyl]-dimethyl-propan-2-ylammonium iodide IUPAC Name: [4-hydroxy-4-(2-phenylphenyl)butyl]-dimethyl-propan-2-ylazanium iodide Traditional Name: [4-hydroxy-4-(2-phenylphenyl)butyl]-isopropyl-dimethyl-ammonium iodide Formula: C21H30INO MolecularWeight: 439.37347

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](C)(C)CCCC(C1=CC=CC=C1C2=CC=CC=C2)O.[I-]

Isomeric SMILES

CC(C)[N+](C)(C)CCCC(C1=CC=CC=C1C2=CC=CC=C2)O.[I-]

InChI

InChI=1S/C21H30NO.HI/c1-17(2)22(3,4)16-10-15-21(23)20-14-9-8-13-19(20)18-11-6-5-7-12-18;/h5-9,11-14,17,21,23H,10,15-16H2,1-4H3;1H/q+1;/p-1