(Z)-2-(2-ethylhexyl)-3-[2-(3-methoxypropoxy)-2-oxidanylidene-ethyl]but-2-enedioic acid

Systemtic Name: (Z)-2-(2-ethylhexyl)-3-[2-(3-methoxypropoxy)-2-oxidanylidene-ethyl]but-2-enedioic acid Openeye Name: (Z)-2-(2-ethylhexyl)-3-[2-(3-methoxypropoxy)-2-oxo-ethyl]but-2-enedioic acid CAS Name: (Z)-2-(2-ethylhexyl)-3-[2-(3-methoxypropoxy)-2-oxoethyl]-2-butenedioic acid IUPAC Name: (Z)-2-(2-ethylhexyl)-3-[2-(3-methoxypropoxy)-2-oxoethyl]but-2-enedioic acid Traditional Name: (Z)-2-(2-ethylhexyl)-3-[2-keto-2-(3-methoxypropoxy)ethyl]but-2-enedioic acid Formula: C18H30O7 MolecularWeight: 358.4266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(=C(CC(=O)OCCCOC)C(=O)O)C(=O)O

Isomeric SMILES

CCCCC(CC)C/C(=C(\CC(=O)OCCCOC)/C(=O)O)/C(=O)O

InChI

InChI=1S/C18H30O7/c1-4-6-8-13(5-2)11-14(17(20)21)15(18(22)23)12-16(19)25-10-7-9-24-3/h13H,4-12H2,1-3H3,(H,20,21)(H,22,23)/b15-14-