ethyl (2E)-2-[(6,7-dimethoxy-1H-isochromen-1-yl)methylidene]-4-oxidanylidene-pentanoate

Systemtic Name: ethyl (2E)-2-[(6,7-dimethoxy-1H-isochromen-1-yl)methylidene]-4-oxidanylidene-pentanoate Openeye Name: ethyl (2E)-2-[(6,7-dimethoxy-1H-isochromen-1-yl)methylene]-4-oxo-pentanoate CAS Name: (2E)-2-[(6,7-dimethoxy-1H-2-benzopyran-1-yl)methylidene]-4-oxopentanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-[(6,7-dimethoxy-1H-isochromen-1-yl)methylidene]-4-oxopentanoate Traditional Name: (E)-2-acetonyl-3-(6,7-dimethoxy-1H-isochromen-1-yl)acrylic acid ethyl ester Formula: C19H22O6 MolecularWeight: 346.37438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1C2=CC(=C(C=C2C=CO1)OC)OC)CC(=O)C

Isomeric SMILES

CCOC(=O)/C(=C/C1C2=CC(=C(C=C2C=CO1)OC)OC)/CC(=O)C

InChI

InChI=1S/C19H22O6/c1-5-24-19(21)14(8-12(2)20)10-16-15-11-18(23-4)17(22-3)9-13(15)6-7-25-16/h6-7,9-11,16H,5,8H2,1-4H3/b14-10+