5-(6,7-dimethoxy-5,8-dipentoxy-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-(6,7-dimethoxy-5,8-dipentoxy-2-phenyl-1-propan-2-yl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-2-isopropyl-5-(1-isopropyl-6,7-dimethoxy-5,8-dipentoxy-2-phenyl-3,4-dihydro-1H-isoquinolin-3-yl)pentanenitrile CAS Name: 5-(6,7-dimethoxy-5,8-dipentoxy-2-phenyl-1-propan-2-yl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile IUPAC Name: 5-(6,7-dimethoxy-5,8-dipentoxy-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-diamoxy-1-isopropyl-6,7-dimethoxy-2-phenyl-3,4-dihydro-1H-isoquinolin-3-yl)-2-(3,4-dimethoxyphenyl)-2-isopropyl-valeronitrile Formula: C46H66N2O6 MolecularWeight: 743.02604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=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)OCCCCC)OC)OC

Isomeric SMILES

CCCCCOC1=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)OCCCCC)OC)OC

InChI

InChI=1S/C46H66N2O6/c1-11-13-18-27-53-42-37-30-36(23-20-26-46(31-47,33(5)6)34-24-25-38(49-7)39(29-34)50-8)48(35-21-16-15-17-22-35)41(32(3)4)40(37)43(54-28-19-14-12-2)45(52-10)44(42)51-9/h15-17,21-22,24-25,29,32-33,36,41H,11-14,18-20,23,26-28,30H2,1-10H3