(2E)-2-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-5-oxidanylidene-hexanenitrile

Systemtic Name: (2E)-2-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-5-oxidanylidene-hexanenitrile Openeye Name: (2E)-2-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-5-oxo-hexanenitrile CAS Name: (2E)-2-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-5-oxohexanenitrile IUPAC Name: (2E)-2-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-5-oxohexanenitrile Traditional Name: (2E)-2-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-5-keto-hexanenitrile Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=C1C2=CC(=C(C=C2CCN1)OC)OC)C#N

Isomeric SMILES

CC(=O)CC/C(=C\1/C2=CC(=C(C=C2CCN1)OC)OC)/C#N

InChI

InChI=1S/C17H20N2O3/c1-11(20)4-5-13(10-18)17-14-9-16(22-3)15(21-2)8-12(14)6-7-19-17/h8-9,19H,4-7H2,1-3H3/b17-13+