4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dimethoxyphenyl)cyclohexane-1-carbonitrile

Systemtic Name: 4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dimethoxyphenyl)cyclohexane-1-carbonitrile Openeye Name: 4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dimethoxyphenyl)cyclohexanecarbonitrile CAS Name: 4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dimethoxyphenyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dimethoxyphenyl)cyclohexane-1-carbonitrile Traditional Name: 4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dimethoxyphenyl)cyclohexanecarbonitrile Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC(CC2)N3CCC4=CC(=C(C=C4C3)OC)OC)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC(CC2)N3CCC4=CC(=C(C=C4C3)OC)OC)C#N)OC

InChI

InChI=1S/C26H32N2O4/c1-29-22-6-5-20(15-25(22)32-4)26(17-27)10-7-21(8-11-26)28-12-9-18-13-23(30-2)24(31-3)14-19(18)16-28/h5-6,13-15,21H,7-12,16H2,1-4H3