5-(5,8-diethoxy-6,7-dimethoxy-2-phenyl-1-propan-2-yl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-(5,8-diethoxy-6,7-dimethoxy-2-phenyl-1-propan-2-yl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile Openeye Name: 5-(5,8-diethoxy-1-isopropyl-6,7-dimethoxy-2-phenyl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-isopropyl-pentanenitrile CAS Name: 5-(5,8-diethoxy-6,7-dimethoxy-2-phenyl-1-propan-2-yl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile IUPAC Name: 5-(5,8-diethoxy-6,7-dimethoxy-2-phenyl-1-propan-2-yl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile Traditional Name: 5-(5,8-diethoxy-1-isopropyl-6,7-dimethoxy-2-phenyl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-isopropyl-valeronitrile Formula: C40H54N2O6 MolecularWeight: 658.86656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C2=C1CC(N(C2C(C)C)C3=CC=CC=C3)CCCC(C#N)(C4=CC(=C(C=C4)OC)OC)C(C)C)OCC)OC)OC

Isomeric SMILES

CCOC1=C(C(=C(C2=C1CC(N(C2C(C)C)C3=CC=CC=C3)CCCC(C#N)(C4=CC(=C(C=C4)OC)OC)C(C)C)OCC)OC)OC

InChI

InChI=1S/C40H54N2O6/c1-11-47-36-31-24-30(19-16-22-40(25-41,27(5)6)28-20-21-32(43-7)33(23-28)44-8)42(29-17-14-13-15-18-29)35(26(3)4)34(31)37(48-12-2)39(46-10)38(36)45-9/h13-15,17-18,20-21,23,26-27,30,35H,11-12,16,19,22,24H2,1-10H3