4-bromanyl-7-methoxy-6-phenylmethoxy-N-pyridin-4-yl-3,4-dihydro-1H-isoquinolin-2-amine

Systemtic Name: 4-bromanyl-7-methoxy-6-phenylmethoxy-N-pyridin-4-yl-3,4-dihydro-1H-isoquinolin-2-amine Openeye Name: 6-benzyloxy-4-bromo-7-methoxy-N-(4-pyridyl)-3,4-dihydro-1H-isoquinolin-2-amine CAS Name: 4-bromo-7-methoxy-6-phenylmethoxy-N-pyridin-4-yl-3,4-dihydro-1H-isoquinolin-2-amine IUPAC Name: 4-bromo-7-methoxy-6-phenylmethoxy-N-pyridin-4-yl-3,4-dihydro-1H-isoquinolin-2-amine Traditional Name: (6-benzoxy-4-bromo-7-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(4-pyridyl)amine Formula: C22H22BrN3O2 MolecularWeight: 440.33298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(CN(CC2=C1)NC3=CC=NC=C3)Br)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C2C(CN(CC2=C1)NC3=CC=NC=C3)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C22H22BrN3O2/c1-27-21-11-17-13-26(25-18-7-9-24-10-8-18)14-20(23)19(17)12-22(21)28-15-16-5-3-2-4-6-16/h2-12,20H,13-15H2,1H3,(H,24,25)