diethyl 2,3-bis(oxidanyl)butanedioate; (2E)-3,7-dimethylocta-2,6-dienal

Systemtic Name: diethyl 2,3-bis(oxidanyl)butanedioate; (2E)-3,7-dimethylocta-2,6-dienal Openeye Name: diethyl 2,3-dihydroxybutanedioate; (2E)-3,7-dimethylocta-2,6-dienal CAS Name: 2,3-dihydroxybutanedioic acid diethyl ester; (2E)-3,7-dimethylocta-2,6-dienal IUPAC Name: diethyl 2,3-dihydroxybutanedioate; (2E)-3,7-dimethylocta-2,6-dienal Traditional Name: 2,3-dihydroxysuccinic acid diethyl ester; (2E)-3,7-dimethylocta-2,6-dienal Formula: C18H30O7 MolecularWeight: 358.4266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C(=O)OCC)O)O.CC(=CCCC(=CC=O)C)C

Isomeric SMILES

CCOC(=O)C(C(C(=O)OCC)O)O.CC(=CCC/C(=C/C=O)/C)C

InChI

InChI=1S/C10H16O.C8H14O6/c1-9(2)5-4-6-10(3)7-8-11;1-3-13-7(11)5(9)6(10)8(12)14-4-2/h5,7-8H,4,6H2,1-3H3;5-6,9-10H,3-4H2,1-2H3/b10-7+;