4-(phenylmethyl)-1-propyl-pyridin-1-ium iodide

Systemtic Name: 4-(phenylmethyl)-1-propyl-pyridin-1-ium iodide Openeye Name: 4-benzyl-1-propyl-pyridin-1-ium iodide CAS Name: 4-(phenylmethyl)-1-propylpyridin-1-ium iodide IUPAC Name: 4-benzyl-1-propylpyridin-1-ium iodide Traditional Name: 4-benzyl-1-propyl-pyridin-1-ium iodide Formula: C15H18IN MolecularWeight: 339.21459

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=CC=C(C=C1)CC2=CC=CC=C2.[I-]

Isomeric SMILES

CCC[N+]1=CC=C(C=C1)CC2=CC=CC=C2.[I-]

InChI

InChI=1S/C15H18N.HI/c1-2-10-16-11-8-15(9-12-16)13-14-6-4-3-5-7-14;/h3-9,11-12H,2,10,13H2,1H3;1H/q+1;/p-1