(E)-2-ethyl-3-phenacyl-but-2-enedioic acid

Systemtic Name: (E)-2-ethyl-3-phenacyl-but-2-enedioic acid Openeye Name: (E)-2-ethyl-3-phenacyl-but-2-enedioic acid CAS Name: (E)-2-ethyl-3-phenacyl-2-butenedioic acid IUPAC Name: (E)-2-ethyl-3-phenacylbut-2-enedioic acid Traditional Name: (E)-2-ethyl-3-phenacyl-but-2-enedioic acid Formula: C14H14O5 MolecularWeight: 262.25796

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(CC(=O)C1=CC=CC=C1)C(=O)O)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C14H14O5/c1-2-10(13(16)17)11(14(18)19)8-12(15)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,16,17)(H,18,19)/b11-10+