ethyl (2E,4E)-5-[6-(3-oxidanylidenebutyl)-1,3-benzodioxol-5-yl]penta-2,4-dienoate

Systemtic Name: ethyl (2E,4E)-5-[6-(3-oxidanylidenebutyl)-1,3-benzodioxol-5-yl]penta-2,4-dienoate Openeye Name: ethyl (2E,4E)-5-[6-(3-oxobutyl)-1,3-benzodioxol-5-yl]penta-2,4-dienoate CAS Name: (2E,4E)-5-[6-(3-oxobutyl)-1,3-benzodioxol-5-yl]penta-2,4-dienoic acid ethyl ester IUPAC Name: ethyl (2E,4E)-5-[6-(3-oxobutyl)-1,3-benzodioxol-5-yl]penta-2,4-dienoate Traditional Name: (2E,4E)-5-[6-(3-ketobutyl)-1,3-benzodioxol-5-yl]penta-2,4-dienoic acid ethyl ester Formula: C18H20O5 MolecularWeight: 316.3484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC=CC1=CC2=C(C=C1CCC(=O)C)OCO2

Isomeric SMILES

CCOC(=O)/C=C/C=C/C1=CC2=C(C=C1CCC(=O)C)OCO2

InChI

InChI=1S/C18H20O5/c1-3-21-18(20)7-5-4-6-14-10-16-17(23-12-22-16)11-15(14)9-8-13(2)19/h4-7,10-11H,3,8-9,12H2,1-2H3/b6-4+,7-5+