2-[[(2-ethylphenyl)amino]methylidene]propanedioic acid

Systemtic Name: 2-[[(2-ethylphenyl)amino]methylidene]propanedioic acid Openeye Name: 2-[(2-ethylanilino)methylene]propanedioic acid CAS Name: 2-[(2-ethylanilino)methylidene]propanedioic acid IUPAC Name: 2-[(2-ethylanilino)methylidene]propanedioic acid Traditional Name: 2-[(2-ethylanilino)methylene]malonic acid Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC=C(C(=O)O)C(=O)O

Isomeric SMILES

CCC1=CC=CC=C1NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C12H13NO4/c1-2-8-5-3-4-6-10(8)13-7-9(11(14)15)12(16)17/h3-7,13H,2H2,1H3,(H,14,15)(H,16,17)