O4-(2-oxidanylbutyl) O1-[2-[(E)-4-oxidanylidenepent-2-enoyl]oxyethyl] (E)-but-2-enedioate

Systemtic Name: O4-(2-oxidanylbutyl) O1-[2-[(E)-4-oxidanylidenepent-2-enoyl]oxyethyl] (E)-but-2-enedioate Openeye Name: O4-(2-hydroxybutyl) O1-[2-[(E)-4-oxopent-2-enoyl]oxyethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-[2-[(E)-1,4-dioxopent-2-enoxy]ethyl] ester O4-(2-hydroxybutyl) ester IUPAC Name: 4-O-(2-hydroxybutyl) 1-O-[2-[(E)-4-oxopent-2-enoyl]oxyethyl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-(2-hydroxybutyl) ester O1-[2-[(E)-4-ketopent-2-enoyl]oxyethyl] ester Formula: C15H20O8 MolecularWeight: 328.3145

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)C=CC(=O)OCCOC(=O)C=CC(=O)C)O

Isomeric SMILES

CCC(COC(=O)/C=C/C(=O)OCCOC(=O)/C=C/C(=O)C)O

InChI

InChI=1S/C15H20O8/c1-3-12(17)10-23-15(20)7-6-14(19)22-9-8-21-13(18)5-4-11(2)16/h4-7,12,17H,3,8-10H2,1-2H3/b5-4+,7-6+