2-[(2,4-dinitrophenyl)amino]-3-methyl-butanoate

Systemtic Name: 2-[(2,4-dinitrophenyl)amino]-3-methyl-butanoate Openeye Name: 2-(2,4-dinitroanilino)-3-methyl-butanoate CAS Name: 2-(2,4-dinitroanilino)-3-methylbutanoate IUPAC Name: 2-(2,4-dinitroanilino)-3-methylbutanoate Traditional Name: 2-(2,4-dinitroanilino)-3-methyl-butyrate Formula: C11H12N3O6- MolecularWeight: 282.22948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O6/c1-6(2)10(11(15)16)12-8-4-3-7(13(17)18)5-9(8)14(19)20/h3-6,10,12H,1-2H3,(H,15,16)/p-1