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

Systemtic Name: 2-[(4-methyl-2-nitro-phenyl)amino]butanoic acid Openeye Name: 2-(4-methyl-2-nitro-anilino)butanoic acid CAS Name: 2-(4-methyl-2-nitroanilino)butanoic acid IUPAC Name: 2-(4-methyl-2-nitroanilino)butanoic acid Traditional Name: 2-(4-methyl-2-nitro-anilino)butyric acid Formula: C11H14N2O4 MolecularWeight: 238.23986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O4/c1-3-8(11(14)15)12-9-5-4-7(2)6-10(9)13(16)17/h4-6,8,12H,3H2,1-2H3,(H,14,15)