O1-hexyl O4-octyl (E)-but-2-enedioate

Systemtic Name: O1-hexyl O4-octyl (E)-but-2-enedioate Openeye Name: O1-hexyl O4-octyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-hexyl ester O4-octyl ester IUPAC Name: 1-O-hexyl 4-O-octyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-hexyl ester O4-octyl ester Formula: C18H32O4 MolecularWeight: 312.44428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C=CC(=O)OCCCCCC

Isomeric SMILES

CCCCCCCCOC(=O)/C=C/C(=O)OCCCCCC

InChI

InChI=1S/C18H32O4/c1-3-5-7-9-10-12-16-22-18(20)14-13-17(19)21-15-11-8-6-4-2/h13-14H,3-12,15-16H2,1-2H3/b14-13+