(Z)-2-ethyl-3-hexyl-but-2-enedioic acid

Systemtic Name: (Z)-2-ethyl-3-hexyl-but-2-enedioic acid Openeye Name: (Z)-2-ethyl-3-hexyl-but-2-enedioic acid CAS Name: (Z)-2-ethyl-3-hexyl-2-butenedioic acid IUPAC Name: (Z)-2-ethyl-3-hexylbut-2-enedioic acid Traditional Name: (Z)-2-ethyl-3-hexyl-but-2-enedioic acid Formula: C12H20O4 MolecularWeight: 228.2848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=C(CC)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCC/C(=C(\CC)/C(=O)O)/C(=O)O

InChI

InChI=1S/C12H20O4/c1-3-5-6-7-8-10(12(15)16)9(4-2)11(13)14/h3-8H2,1-2H3,(H,13,14)(H,15,16)/b10-9-