3-[(2-aminocarbonyl-4-nitro-phenyl)amino]propanoic acid

Systemtic Name: 3-[(2-aminocarbonyl-4-nitro-phenyl)amino]propanoic acid Openeye Name: 3-(2-carbamoyl-4-nitro-anilino)propanoic acid CAS Name: 3-(2-carbamoyl-4-nitroanilino)propanoic acid IUPAC Name: 3-(2-carbamoyl-4-nitroanilino)propanoic acid Traditional Name: 3-(2-carbamoyl-4-nitro-anilino)propionic acid Formula: C10H11N3O5 MolecularWeight: 253.21144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11N3O5/c11-10(16)7-5-6(13(17)18)1-2-8(7)12-4-3-9(14)15/h1-2,5,12H,3-4H2,(H2,11,16)(H,14,15)