2-[(2-methyl-4-nitro-phenyl)amino]propanoic acid

Systemtic Name: 2-[(2-methyl-4-nitro-phenyl)amino]propanoic acid Openeye Name: 2-(2-methyl-4-nitro-anilino)propanoic acid CAS Name: 2-(2-methyl-4-nitroanilino)propanoic acid IUPAC Name: 2-(2-methyl-4-nitroanilino)propanoic acid Traditional Name: 2-(2-methyl-4-nitro-anilino)propionic acid Formula: C10H12N2O4 MolecularWeight: 224.21328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12N2O4/c1-6-5-8(12(15)16)3-4-9(6)11-7(2)10(13)14/h3-5,7,11H,1-2H3,(H,13,14)