ethyl 3-[(3-oxidanylidene-4,5,6,7-tetrahydro-1H-2-benzofuran-1-yl)methyl]penta-3,4-dienoate

Systemtic Name: ethyl 3-[(3-oxidanylidene-4,5,6,7-tetrahydro-1H-2-benzofuran-1-yl)methyl]penta-3,4-dienoate Openeye Name: ethyl 3-[(3-oxo-4,5,6,7-tetrahydro-1H-isobenzofuran-1-yl)methyl]penta-3,4-dienoate CAS Name: 3-[(3-oxo-4,5,6,7-tetrahydro-1H-isobenzofuran-1-yl)methyl]penta-3,4-dienoic acid ethyl ester IUPAC Name: ethyl 3-[(3-oxo-4,5,6,7-tetrahydro-1H-2-benzofuran-1-yl)methyl]penta-3,4-dienoate Traditional Name: 3-[(3-keto-4,5,6,7-tetrahydro-1H-isobenzofuran-1-yl)methyl]penta-3,4-dienoic acid ethyl ester Formula: C16H20O4 MolecularWeight: 276.3276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=C=C)CC1C2=C(CCCC2)C(=O)O1

Isomeric SMILES

CCOC(=O)CC(=C=C)CC1C2=C(CCCC2)C(=O)O1

InChI

InChI=1S/C16H20O4/c1-3-11(10-15(17)19-4-2)9-14-12-7-5-6-8-13(12)16(18)20-14/h14H,1,4-10H2,2H3