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

Systemtic Name: 5-(6,7-dimethoxy-1-pentan-2-yl-5,8-dipentoxy-2-phenyl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile Openeye Name: 5-[6,7-dimethoxy-1-(1-methylbutyl)-5,8-dipentoxy-2-phenyl-3,4-dihydro-1H-isoquinolin-3-yl]-2-(3,4-dimethoxyphenyl)-2-isopropyl-pentanenitrile CAS Name: 5-(6,7-dimethoxy-1-pentan-2-yl-5,8-dipentoxy-2-phenyl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile IUPAC Name: 5-(6,7-dimethoxy-1-pentan-2-yl-5,8-dipentoxy-2-phenyl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile Traditional Name: 5-[5,8-diamoxy-6,7-dimethoxy-1-(1-methylbutyl)-2-phenyl-3,4-dihydro-1H-isoquinolin-3-yl]-2-(3,4-dimethoxyphenyl)-2-isopropyl-valeronitrile Formula: C48H70N2O6 MolecularWeight: 771.0792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C(=C(C2=C1CC(N(C2C(C)CCC)C3=CC=CC=C3)CCCC(C#N)(C4=CC(=C(C=C4)OC)OC)C(C)C)OCCCCC)OC)OC

Isomeric SMILES

CCCCCOC1=C(C(=C(C2=C1CC(N(C2C(C)CCC)C3=CC=CC=C3)CCCC(C#N)(C4=CC(=C(C=C4)OC)OC)C(C)C)OCCCCC)OC)OC

InChI

InChI=1S/C48H70N2O6/c1-11-14-19-29-55-44-39-32-38(25-21-28-48(33-49,34(4)5)36-26-27-40(51-7)41(31-36)52-8)50(37-23-17-16-18-24-37)43(35(6)22-13-3)42(39)45(56-30-20-15-12-2)47(54-10)46(44)53-9/h16-18,23-24,26-27,31,34-35,38,43H,11-15,19-22,25,28-30,32H2,1-10H3