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

Systemtic Name: 2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pentanedinitrile Openeye Name: 2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pentanedinitrile CAS Name: 2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pentanedinitrile IUPAC Name: 2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]pentanedinitrile Traditional Name: 2-[(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]glutaronitrile Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CC(CCC#N)C#N)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CC(CCC#N)C#N)OC

InChI

InChI=1S/C17H21N3O2/c1-21-16-8-14-5-7-20(11-13(10-19)4-3-6-18)12-15(14)9-17(16)22-2/h8-9,13H,3-5,7,11-12H2,1-2H3