4-[[1-[2,3-bis(chloranyl)phenyl]-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[1-[2,3-bis(chloranyl)phenyl]-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[1-(2,3-dichlorophenyl)-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]benzonitrile CAS Name: 4-[[1-(2,3-dichlorophenyl)-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]benzonitrile IUPAC Name: 4-[[1-(2,3-dichlorophenyl)-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]benzonitrile Traditional Name: 4-[[1-(2,3-dichlorophenyl)-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]benzonitrile Formula: C25H22Cl2N2O2 MolecularWeight: 453.36038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CCN(C(C2=C(C=C1)OC)C3=C(C(=CC=C3)Cl)Cl)CC4=CC=C(C=C4)C#N

Isomeric SMILES

COC1=C2CCN(C(C2=C(C=C1)OC)C3=C(C(=CC=C3)Cl)Cl)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H22Cl2N2O2/c1-30-21-10-11-22(31-2)23-18(21)12-13-29(15-17-8-6-16(14-28)7-9-17)25(23)19-4-3-5-20(26)24(19)27/h3-11,25H,12-13,15H2,1-2H3