2-[(4-methyl-3,5-dinitro-phenyl)amino]ethanoic acid

Systemtic Name: 2-[(4-methyl-3,5-dinitro-phenyl)amino]ethanoic acid Openeye Name: 2-(4-methyl-3,5-dinitro-anilino)acetic acid CAS Name: 2-(4-methyl-3,5-dinitroanilino)acetic acid IUPAC Name: 2-(4-methyl-3,5-dinitroanilino)acetic acid Traditional Name: 2-(4-methyl-3,5-dinitro-anilino)acetic acid Formula: C9H9N3O6 MolecularWeight: 255.18426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9N3O6/c1-5-7(11(15)16)2-6(10-4-9(13)14)3-8(5)12(17)18/h2-3,10H,4H2,1H3,(H,13,14)