O4-[1-[(E)-4-butoxy-4-oxidanylidene-but-2-enoyl]oxybutyl] O1-butyl (E)-but-2-enedioate

Systemtic Name: O4-[1-[(E)-4-butoxy-4-oxidanylidene-but-2-enoyl]oxybutyl] O1-butyl (E)-but-2-enedioate Openeye Name: O4-[1-[(E)-4-butoxy-4-oxo-but-2-enoyl]oxybutyl] O1-butyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[1-[(E)-4-butoxy-1,4-dioxobut-2-enoxy]butyl] ester O1-butyl ester IUPAC Name: 4-O-[1-[(E)-4-butoxy-4-oxobut-2-enoyl]oxybutyl] 1-O-butyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[1-[(E)-4-butoxy-4-keto-but-2-enoyl]oxybutyl] ester O1-butyl ester Formula: C20H30O8 MolecularWeight: 398.4474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C=CC(=O)OC(CCC)OC(=O)C=CC(=O)OCCCC

Isomeric SMILES

CCCCOC(=O)/C=C/C(=O)OC(OC(=O)/C=C/C(=O)OCCCC)CCC

InChI

InChI=1S/C20H30O8/c1-4-7-14-25-16(21)10-12-18(23)27-20(9-6-3)28-19(24)13-11-17(22)26-15-8-5-2/h10-13,20H,4-9,14-15H2,1-3H3/b12-10+,13-11+