2-[(4-methylphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[(4-methylphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-(p-tolylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[(4-methylphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[(4-methylphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-(4-methylbenzyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C17H20N+ MolecularWeight: 238.3474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C17H19N/c1-14-6-8-15(9-7-14)12-18-11-10-16-4-2-3-5-17(16)13-18/h2-9H,10-13H2,1H3/p+1