(1E)-1-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-1-nitroso-propan-2-one

Systemtic Name: (1E)-1-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-1-nitroso-propan-2-one Openeye Name: (1E)-1-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-1-nitroso-propan-2-one CAS Name: (1E)-1-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-1-nitroso-2-propanone IUPAC Name: (1E)-1-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-1-nitrosopropan-2-one Traditional Name: (1E)-1-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-1-nitroso-acetone Formula: C14H16N2O4 MolecularWeight: 276.28784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O4/c1-8(17)13(16-18)14-10-7-12(20-3)11(19-2)6-9(10)4-5-15-14/h6-7,15H,4-5H2,1-3H3/b14-13+