2-tert-butyl-3,4-dihydroisoquinolin-2-ium

Systemtic Name: 2-tert-butyl-3,4-dihydroisoquinolin-2-ium Openeye Name: 2-tert-butyl-3,4-dihydroisoquinolin-2-ium CAS Name: 2-tert-butyl-3,4-dihydroisoquinolin-2-ium IUPAC Name: 2-tert-butyl-3,4-dihydroisoquinolin-2-ium Traditional Name: 2-tert-butyl-3,4-dihydroisoquinolin-2-ium Formula: C13H18N+ MolecularWeight: 188.28872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+]1=CC2=CC=CC=C2CC1

Isomeric SMILES

CC(C)(C)[N+]1=CC2=CC=CC=C2CC1

InChI

InChI=1S/C13H18N/c1-13(2,3)14-9-8-11-6-4-5-7-12(11)10-14/h4-7,10H,8-9H2,1-3H3/q+1