(E)-2-phenyl-3-propan-2-yl-but-2-enedioate

Systemtic Name: (E)-2-phenyl-3-propan-2-yl-but-2-enedioate Openeye Name: (E)-2-isopropyl-3-phenyl-but-2-enedioate CAS Name: (E)-2-phenyl-3-propan-2-yl-2-butenedioate IUPAC Name: (E)-2-phenyl-3-propan-2-ylbut-2-enedioate Traditional Name: (E)-2-isopropyl-3-phenyl-but-2-enedioate Formula: C13H12O4-2 MolecularWeight: 232.23198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=C(C1=CC=CC=C1)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(C)/C(=C(/C1=CC=CC=C1)\C(=O)[O-])/C(=O)[O-]

InChI

InChI=1S/C13H14O4/c1-8(2)10(12(14)15)11(13(16)17)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,14,15)(H,16,17)/p-2/b11-10+