1-(2-methoxy-1,2-diphenyl-ethyl)-1-methyl-piperidin-1-ium iodide

Systemtic Name: 1-(2-methoxy-1,2-diphenyl-ethyl)-1-methyl-piperidin-1-ium iodide Openeye Name: 1-(2-methoxy-1,2-diphenyl-ethyl)-1-methyl-piperidin-1-ium iodide CAS Name: 1-(2-methoxy-1,2-diphenylethyl)-1-methylpiperidin-1-ium iodide IUPAC Name: 1-(2-methoxy-1,2-diphenylethyl)-1-methylpiperidin-1-ium iodide Traditional Name: 1-(2-methoxy-1,2-diphenyl-ethyl)-1-methyl-piperidin-1-ium iodide Formula: C21H28INO MolecularWeight: 437.35759

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)C(C2=CC=CC=C2)C(C3=CC=CC=C3)OC.[I-]

Isomeric SMILES

C[N+]1(CCCCC1)C(C2=CC=CC=C2)C(C3=CC=CC=C3)OC.[I-]

InChI

InChI=1S/C21H28NO.HI/c1-22(16-10-5-11-17-22)20(18-12-6-3-7-13-18)21(23-2)19-14-8-4-9-15-19;/h3-4,6-9,12-15,20-21H,5,10-11,16-17H2,1-2H3;1H/q+1;/p-1