(3E)-2-ethyl-3-(phenylmethylidene)butanedioate

Systemtic Name: (3E)-2-ethyl-3-(phenylmethylidene)butanedioate Openeye Name: (2E)-2-benzylidene-3-ethyl-butanedioate CAS Name: (3E)-2-ethyl-3-(phenylmethylene)butanedioate IUPAC Name: (2E)-2-benzylidene-3-ethylbutanedioate Traditional Name: (2E)-2-benzal-3-ethyl-succinate Formula: C13H12O4-2 MolecularWeight: 232.23198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=CC1=CC=CC=C1)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C13H14O4/c1-2-10(12(14)15)11(13(16)17)8-9-6-4-3-5-7-9/h3-8,10H,2H2,1H3,(H,14,15)(H,16,17)/p-2/b11-8+