(E)-4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-but-2-enoate CAS Name: (E)-4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-2-butenoate IUPAC Name: (E)-4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobut-2-enoate Traditional Name: (E)-4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-but-2-enoate Formula: C15H16NO5- MolecularWeight: 290.29124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C=CC(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)/C=C/C(=O)[O-])OC

InChI

InChI=1S/C15H17NO5/c1-20-12-7-10-5-6-16(14(17)3-4-15(18)19)9-11(10)8-13(12)21-2/h3-4,7-8H,5-6,9H2,1-2H3,(H,18,19)/p-1/b4-3+