2-ethyl-1,3-dimethyl-3,4-dihydroisoquinolin-2-ium iodide

Systemtic Name: 2-ethyl-1,3-dimethyl-3,4-dihydroisoquinolin-2-ium iodide Openeye Name: 2-ethyl-1,3-dimethyl-3,4-dihydroisoquinolin-2-ium iodide CAS Name: 2-ethyl-1,3-dimethyl-3,4-dihydroisoquinolin-2-ium iodide IUPAC Name: 2-ethyl-1,3-dimethyl-3,4-dihydroisoquinolin-2-ium iodide Traditional Name: 2-ethyl-1,3-dimethyl-3,4-dihydroisoquinolin-2-ium iodide Formula: C13H18IN MolecularWeight: 315.19319

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C2=CC=CC=C2CC1C)C.[I-]

Isomeric SMILES

CC[N+]1=C(C2=CC=CC=C2CC1C)C.[I-]

InChI

InChI=1S/C13H18N.HI/c1-4-14-10(2)9-12-7-5-6-8-13(12)11(14)3;/h5-8,10H,4,9H2,1-3H3;1H/q+1;/p-1