(Z)-2-(2-ethylhexyl)but-2-enedioate

Systemtic Name: (Z)-2-(2-ethylhexyl)but-2-enedioate Openeye Name: (Z)-2-(2-ethylhexyl)but-2-enedioate CAS Name: (Z)-2-(2-ethylhexyl)-2-butenedioate IUPAC Name: (Z)-2-(2-ethylhexyl)but-2-enedioate Traditional Name: (Z)-2-(2-ethylhexyl)but-2-enedioate Formula: C12H18O4-2 MolecularWeight: 226.26892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCC(CC)C/C(=C/C(=O)[O-])/C(=O)[O-]

InChI

InChI=1S/C12H20O4/c1-3-5-6-9(4-2)7-10(12(15)16)8-11(13)14/h8-9H,3-7H2,1-2H3,(H,13,14)(H,15,16)/p-2/b10-8-