6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-hex-4-ynenitrile

Systemtic Name: 6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-hex-4-ynenitrile Openeye Name: 6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,4-dimethoxyphenyl)-2-isopropyl-hex-4-ynenitrile CAS Name: 6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-yl-4-hexynenitrile IUPAC Name: 6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,4-dimethoxyphenyl)-2-propan-2-ylhex-4-ynenitrile Traditional Name: 6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(3,4-dimethoxyphenyl)-2-isopropyl-hex-4-ynenitrile Formula: C28H34N2O4 MolecularWeight: 462.58056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC#CCN1CCC2=CC(=C(C=C2C1)OC)OC)(C#N)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)C(CC#CCN1CCC2=CC(=C(C=C2C1)OC)OC)(C#N)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C28H34N2O4/c1-20(2)28(19-29,23-9-10-24(31-3)27(17-23)34-6)12-7-8-13-30-14-11-21-15-25(32-4)26(33-5)16-22(21)18-30/h9-10,15-17,20H,11-14,18H2,1-6H3