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

Systemtic Name: O4-hexyl O1-propyl (E)-but-2-enedioate Openeye Name: O4-hexyl O1-propyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-hexyl ester O1-propyl ester IUPAC Name: 4-O-hexyl 1-O-propyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-hexyl ester O1-propyl ester Formula: C13H22O4 MolecularWeight: 242.31138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C=CC(=O)OCCC

Isomeric SMILES

CCCCCCOC(=O)/C=C/C(=O)OCCC

InChI

InChI=1S/C13H22O4/c1-3-5-6-7-11-17-13(15)9-8-12(14)16-10-4-2/h8-9H,3-7,10-11H2,1-2H3/b9-8+