2-[(4-cyano-5-methyl-2-nitro-phenyl)amino]ethanoic acid

Systemtic Name: 2-[(4-cyano-5-methyl-2-nitro-phenyl)amino]ethanoic acid Openeye Name: 2-(4-cyano-5-methyl-2-nitro-anilino)acetic acid CAS Name: 2-(4-cyano-5-methyl-2-nitroanilino)acetic acid IUPAC Name: 2-(4-cyano-5-methyl-2-nitroanilino)acetic acid Traditional Name: 2-(4-cyano-5-methyl-2-nitro-anilino)acetic acid Formula: C10H9N3O4 MolecularWeight: 235.19616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C#N)[N+](=O)[O-])NCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1C#N)[N+](=O)[O-])NCC(=O)O

InChI

InChI=1S/C10H9N3O4/c1-6-2-8(12-5-10(14)15)9(13(16)17)3-7(6)4-11/h2-3,12H,5H2,1H3,(H,14,15)