5-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-pentanenitrile Openeye Name: 5-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(3,4-dimethoxyphenyl)-2-isopropyl-pentanenitrile CAS Name: 5-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile IUPAC Name: 5-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-ylpentanenitrile Traditional Name: 5-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(3,4-dimethoxyphenyl)-2-isopropyl-valeronitrile Formula: C27H34N2O4 MolecularWeight: 450.56986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC1=NCCC2=CC(=C(C=C21)OC)OC)(C#N)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)C(CCCC1=NCCC2=CC(=C(C=C21)OC)OC)(C#N)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C27H34N2O4/c1-18(2)27(17-28,20-9-10-23(30-3)25(15-20)32-5)12-7-8-22-21-16-26(33-6)24(31-4)14-19(21)11-13-29-22/h9-10,14-16,18H,7-8,11-13H2,1-6H3