1-(3-phenylprop-2-ynyl)-1-prop-2-enyl-piperidin-1-ium iodide

Systemtic Name: 1-(3-phenylprop-2-ynyl)-1-prop-2-enyl-piperidin-1-ium iodide Openeye Name: 1-allyl-1-(3-phenylprop-2-ynyl)piperidin-1-ium iodide CAS Name: 1-(3-phenylprop-2-ynyl)-1-prop-2-enylpiperidin-1-ium iodide IUPAC Name: 1-(3-phenylprop-2-ynyl)-1-prop-2-enylpiperidin-1-ium iodide Traditional Name: 1-allyl-1-(3-phenylprop-2-ynyl)piperidin-1-ium iodide Formula: C17H22IN MolecularWeight: 367.26775

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1(CCCCC1)CC#CC2=CC=CC=C2.[I-]

Isomeric SMILES

C=CC[N+]1(CCCCC1)CC#CC2=CC=CC=C2.[I-]

InChI

InChI=1S/C17H22N.HI/c1-2-13-18(14-7-4-8-15-18)16-9-12-17-10-5-3-6-11-17;/h2-3,5-6,10-11H,1,4,7-8,13-16H2;1H/q+1;/p-1