2-[methyl-(4-methyl-2,6-dinitro-phenyl)amino]ethanoic acid

Systemtic Name: 2-[methyl-(4-methyl-2,6-dinitro-phenyl)amino]ethanoic acid Openeye Name: 2-(N,4-dimethyl-2,6-dinitro-anilino)acetic acid CAS Name: 2-(N,4-dimethyl-2,6-dinitroanilino)acetic acid IUPAC Name: 2-(N,4-dimethyl-2,6-dinitroanilino)acetic acid Traditional Name: 2-(N,4-dimethyl-2,6-dinitro-anilino)acetic acid Formula: C10H11N3O6 MolecularWeight: 269.21084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])N(C)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])N(C)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H11N3O6/c1-6-3-7(12(16)17)10(8(4-6)13(18)19)11(2)5-9(14)15/h3-4H,5H2,1-2H3,(H,14,15)