1-[3-[3-(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]phenyl]ethanone

Systemtic Name: 1-[3-[3-(5,8-dimethoxy-4-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanyl-propoxy]phenyl]ethanone Openeye Name: 1-[3-[2-hydroxy-3-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propoxy]phenyl]ethanone CAS Name: 1-[3-[2-hydroxy-3-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propoxy]phenyl]ethanone IUPAC Name: 1-[3-[2-hydroxy-3-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propoxy]phenyl]ethanone Traditional Name: 1-[3-[2-hydroxy-3-(4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propoxy]phenyl]ethanone Formula: C22H27NO6 MolecularWeight: 401.45288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OCC(CN2CC(C3=C(C=CC(=C3C2)OC)OC)O)O

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OCC(CN2CC(C3=C(C=CC(=C3C2)OC)OC)O)O

InChI

InChI=1S/C22H27NO6/c1-14(24)15-5-4-6-17(9-15)29-13-16(25)10-23-11-18-20(27-2)7-8-21(28-3)22(18)19(26)12-23/h4-9,16,19,25-26H,10-13H2,1-3H3