1-methyl-1-(5-methyl-3-phenyl-hex-4-enyl)piperidin-1-ium iodide

Systemtic Name: 1-methyl-1-(5-methyl-3-phenyl-hex-4-enyl)piperidin-1-ium iodide Openeye Name: 1-methyl-1-(5-methyl-3-phenyl-hex-4-enyl)piperidin-1-ium iodide CAS Name: 1-methyl-1-(5-methyl-3-phenylhex-4-enyl)piperidin-1-ium iodide IUPAC Name: 1-methyl-1-(5-methyl-3-phenylhex-4-enyl)piperidin-1-ium iodide Traditional Name: 1-methyl-1-(5-methyl-3-phenyl-hex-4-enyl)piperidin-1-ium iodide Formula: C19H30IN MolecularWeight: 399.35267

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N.HI/c1-17(2)16-19(18-10-6-4-7-11-18)12-15-20(3)13-8-5-9-14-20;/h4,6-7,10-11,16,19H,5,8-9,12-15H2,1-3H3;1H/q+1;/p-1