2-[(4-tert-butylphenyl)carbonylamino]propanedioic acid

Systemtic Name: 2-[(4-tert-butylphenyl)carbonylamino]propanedioic acid Openeye Name: 2-[(4-tert-butylbenzoyl)amino]propanedioic acid CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]amino]propanedioic acid IUPAC Name: 2-[(4-tert-butylbenzoyl)amino]propanedioic acid Traditional Name: 2-[(4-tert-butylbenzoyl)amino]malonic acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(C(=O)O)C(=O)O

InChI

InChI=1S/C14H17NO5/c1-14(2,3)9-6-4-8(5-7-9)11(16)15-10(12(17)18)13(19)20/h4-7,10H,1-3H3,(H,15,16)(H,17,18)(H,19,20)