(E)-2-(2-oxidanylidenedecyl)-3-phenyl-but-2-enedioic acid

Systemtic Name: (E)-2-(2-oxidanylidenedecyl)-3-phenyl-but-2-enedioic acid Openeye Name: (E)-2-(2-oxodecyl)-3-phenyl-but-2-enedioic acid CAS Name: (E)-2-(2-oxodecyl)-3-phenyl-2-butenedioic acid IUPAC Name: (E)-2-(2-oxodecyl)-3-phenylbut-2-enedioic acid Traditional Name: (E)-2-(2-ketodecyl)-3-phenyl-but-2-enedioic acid Formula: C20H26O5 MolecularWeight: 346.41744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)CC(=C(C1=CC=CC=C1)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCC(=O)C/C(=C(/C1=CC=CC=C1)\C(=O)O)/C(=O)O

InChI

InChI=1S/C20H26O5/c1-2-3-4-5-6-10-13-16(21)14-17(19(22)23)18(20(24)25)15-11-8-7-9-12-15/h7-9,11-12H,2-6,10,13-14H2,1H3,(H,22,23)(H,24,25)/b18-17+