3,3-dimethyl-2-[(4-nitrophenyl)carbonylamino]butanoic acid

Systemtic Name: 3,3-dimethyl-2-[(4-nitrophenyl)carbonylamino]butanoic acid Openeye Name: 3,3-dimethyl-2-[(4-nitrobenzoyl)amino]butanoic acid CAS Name: 3,3-dimethyl-2-[[(4-nitrophenyl)-oxomethyl]amino]butanoic acid IUPAC Name: 3,3-dimethyl-2-[(4-nitrobenzoyl)amino]butanoic acid Traditional Name: 3,3-dimethyl-2-[(4-nitrobenzoyl)amino]butyric acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C(C(=O)O)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O5/c1-13(2,3)10(12(17)18)14-11(16)8-4-6-9(7-5-8)15(19)20/h4-7,10H,1-3H3,(H,14,16)(H,17,18)