1-[[(4-methylphenyl)amino]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol dihydrobromide

Systemtic Name: 1-[[(4-methylphenyl)amino]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol dihydrobromide Openeye Name: 1-[(4-methylanilino)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol dihydrobromide CAS Name: 1-[(4-methylanilino)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol dihydrobromide IUPAC Name: 1-[(4-methylanilino)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol dihydrobromide Traditional Name: 1-(p-toluidinomethyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol dihydrobromide Formula: C17H22Br2N2O2 MolecularWeight: 446.17678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC2C3=CC(=C(C=C3CCN2)O)O.Br.Br

Isomeric SMILES

CC1=CC=C(C=C1)NCC2C3=CC(=C(C=C3CCN2)O)O.Br.Br

InChI

InChI=1S/C17H20N2O2.2BrH/c1-11-2-4-13(5-3-11)19-10-15-14-9-17(21)16(20)8-12(14)6-7-18-15;;/h2-5,8-9,15,18-21H,6-7,10H2,1H3;2*1H