2-[(2,4-dinitrophenyl)amino]-2-methyl-butanoic acid

Systemtic Name: 2-[(2,4-dinitrophenyl)amino]-2-methyl-butanoic acid Openeye Name: 2-(2,4-dinitroanilino)-2-methyl-butanoic acid CAS Name: 2-(2,4-dinitroanilino)-2-methylbutanoic acid IUPAC Name: 2-(2,4-dinitroanilino)-2-methylbutanoic acid Traditional Name: 2-(2,4-dinitroanilino)-2-methyl-butyric acid Formula: C11H13N3O6 MolecularWeight: 283.23742

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)O)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C(=O)O)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O6/c1-3-11(2,10(15)16)12-8-5-4-7(13(17)18)6-9(8)14(19)20/h4-6,12H,3H2,1-2H3,(H,15,16)