ethenyl ethanoate; (Z)-4-(2-ethylhexoxy)-4-oxidanylidene-but-2-enoic acid; furan-2,5-dione

Systemtic Name: ethenyl ethanoate; (Z)-4-(2-ethylhexoxy)-4-oxidanylidene-but-2-enoic acid; furan-2,5-dione Openeye Name: (Z)-4-(2-ethylhexoxy)-4-oxo-but-2-enoic acid; furan-2,5-dione; vinyl acetate CAS Name: acetic acid ethenyl ester; (Z)-4-(2-ethylhexoxy)-4-oxo-2-butenoic acid; furan-2,5-dione IUPAC Name: ethenyl acetate; (Z)-4-(2-ethylhexoxy)-4-oxobut-2-enoic acid; furan-2,5-dione Traditional Name: acetic acid vinyl ester; (Z)-4-(2-ethylhexoxy)-4-keto-but-2-enoic acid; furan-2,5-quinone Formula: C20H28O9 MolecularWeight: 412.43092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C=CC(=O)O.CC(=O)OC=C.C1=CC(=O)OC1=O

Isomeric SMILES

CCCCC(CC)COC(=O)/C=C\C(=O)O.CC(=O)OC=C.C1=CC(=O)OC1=O

InChI

InChI=1S/C12H20O4.C4H2O3.C4H6O2/c1-3-5-6-10(4-2)9-16-12(15)8-7-11(13)14;5-3-1-2-4(6)7-3;1-3-6-4(2)5/h7-8,10H,3-6,9H2,1-2H3,(H,13,14);1-2H;3H,1H2,2H3/b8-7-;;