2-[(4-ethylphenyl)carbonylamino]propanedioate

Systemtic Name: 2-[(4-ethylphenyl)carbonylamino]propanedioate Openeye Name: 2-[(4-ethylbenzoyl)amino]propanedioate CAS Name: 2-[[(4-ethylphenyl)-oxomethyl]amino]propanedioate IUPAC Name: 2-[(4-ethylbenzoyl)amino]propanedioate Traditional Name: 2-[(4-ethylbenzoyl)amino]malonate Formula: C12H11NO5-2 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C12H13NO5/c1-2-7-3-5-8(6-4-7)10(14)13-9(11(15)16)12(17)18/h3-6,9H,2H2,1H3,(H,13,14)(H,15,16)(H,17,18)/p-2