2-[1-(4-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanenitrile

Systemtic Name: 2-[1-(4-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanenitrile Openeye Name: 2-[1-(4-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]acetonitrile CAS Name: 2-[1-(4-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]acetonitrile IUPAC Name: 2-[1-(4-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]acetonitrile Traditional Name: 2-[1-(4-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]acetonitrile Formula: C19H19ClN2O2 MolecularWeight: 342.81936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC#N)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CC#N)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C19H19ClN2O2/c1-23-17-11-14-7-9-22(10-8-21)19(16(14)12-18(17)24-2)13-3-5-15(20)6-4-13/h3-6,11-12,19H,7,9-10H2,1-2H3