(Z)-4-butan-2-yloxy-4-oxidanylidene-but-2-enoic acid; ethenylbenzene; furan-2,5-dione; (Z)-4-methoxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (Z)-4-butan-2-yloxy-4-oxidanylidene-but-2-enoic acid; ethenylbenzene; furan-2,5-dione; (Z)-4-methoxy-4-oxidanylidene-but-2-enoic acid Openeye Name: furan-2,5-dione; (Z)-4-methoxy-4-oxo-but-2-enoic acid; (Z)-4-oxo-4-sec-butoxy-but-2-enoic acid; styrene CAS Name: (Z)-4-butan-2-yloxy-4-oxo-2-butenoic acid; furan-2,5-dione; (Z)-4-methoxy-4-oxo-2-butenoic acid; styrene IUPAC Name: (Z)-4-butan-2-yloxy-4-oxobut-2-enoic acid; furan-2,5-dione; (Z)-4-methoxy-4-oxobut-2-enoic acid; styrene Traditional Name: furan-2,5-quinone; (Z)-4-keto-4-methoxy-but-2-enoic acid; (Z)-4-keto-4-sec-butoxy-but-2-enoic acid; styrene Formula: C25H28O11 MolecularWeight: 504.48322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C=CC(=O)O.COC(=O)C=CC(=O)O.C=CC1=CC=CC=C1.C1=CC(=O)OC1=O

Isomeric SMILES

CCC(C)OC(=O)/C=C\C(=O)O.COC(=O)/C=C\C(=O)O.C=CC1=CC=CC=C1.C1=CC(=O)OC1=O

InChI

InChI=1S/C8H12O4.C8H8.C5H6O4.C4H2O3/c1-3-6(2)12-8(11)5-4-7(9)10;1-2-8-6-4-3-5-7-8;1-9-5(8)3-2-4(6)7;5-3-1-2-4(6)7-3/h4-6H,3H2,1-2H3,(H,9,10);2-7H,1H2;2-3H,1H3,(H,6,7);1-2H/b5-4-;;3-2-;