2-[(2,3-diethylphenyl)methylidene]propanedioic acid

Systemtic Name: 2-[(2,3-diethylphenyl)methylidene]propanedioic acid Openeye Name: 2-[(2,3-diethylphenyl)methylene]propanedioic acid CAS Name: 2-[(2,3-diethylphenyl)methylidene]propanedioic acid IUPAC Name: 2-[(2,3-diethylphenyl)methylidene]propanedioic acid Traditional Name: 2-(2,3-diethylbenzylidene)malonic acid Formula: C14H16O4 MolecularWeight: 248.27444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1CC)C=C(C(=O)O)C(=O)O

Isomeric SMILES

CCC1=CC=CC(=C1CC)C=C(C(=O)O)C(=O)O

InChI

InChI=1S/C14H16O4/c1-3-9-6-5-7-10(11(9)4-2)8-12(13(15)16)14(17)18/h5-8H,3-4H2,1-2H3,(H,15,16)(H,17,18)