IUPAC Name :(1R)-1-[[4-hydroxy-3-[[(1R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol
InChI :InChI=1/C37H42N2O6/c1-38-15-13-26-20-36(44-5)37(22-29(26)30(38)16-23-6-9-27(42-3)10-7-23)45-35-18-24(8-11-32(35)40)17-31-28-21-33(41)34(43-4)19-25(28)12-14-39(31)2/h6-11,18-22,30-31,40-41H,12-17H2,1-5H3/t30-,31-/m1/s1
Std.InChI: InChI=1S/C37H42N2O6/c1-38-15-13-26-20-36(44-5)37(22-29(26)30(38)16-23-6-9-27(42-3)10-7-23)45-35-18-24(8-11-32(35)40)17-31-28-21-33(41)34(43-4)19-25(28)12-14-39(31)2/h6-11,18-22,30-31,40-41H,12-17H2,1-5H3/t30-,31-/m1/s1
InChIKey :AJPXZTKPPINUKN-FIRIVFDPBX
Std.InChIKey: AJPXZTKPPINUKN-FIRIVFDPSA-N
SMILES :CN1CCC2=CC(=C(C=C2[C@H]1CC3=CC=C(C=C3)OC)OC4=C(C=CC(=C4)C[C@@H]5C6=CC(=C(C=C6CCN5C)OC)O)O)OC
Molar Refractivity :175.72 ± 0.3 cm3 (est)
Parachor :1334.9 ± 6.0 cm3 (est)
Index of Refraction :1.618 ± 0.02
(est)
Surface Tension :50.2 ± 3.0 dyne/cm (est)
Density :1.218 ± 0.06 g/cm3 (est)
Polarizability :69.66 ± 0.5 10-24cm3 (est)