2-methyl-4-propyl-isoquinolin-2-ium

Systemtic Name: 2-methyl-4-propyl-isoquinolin-2-ium Openeye Name: 2-methyl-4-propyl-isoquinolin-2-ium CAS Name: 2-methyl-4-propylisoquinolin-2-ium IUPAC Name: 2-methyl-4-propylisoquinolin-2-ium Traditional Name: 2-methyl-4-propyl-isoquinolin-2-ium Formula: C13H16N+ MolecularWeight: 186.27284

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C[N+](=CC2=CC=CC=C21)C

Isomeric SMILES

CCCC1=C[N+](=CC2=CC=CC=C21)C

InChI

InChI=1S/C13H16N/c1-3-6-11-9-14(2)10-12-7-4-5-8-13(11)12/h4-5,7-10H,3,6H2,1-2H3/q+1