5-azido-2-[(4-nitrophenyl)amino]benzoic acid

Systemtic Name: 5-azido-2-[(4-nitrophenyl)amino]benzoic acid Openeye Name: 5-azido-2-(4-nitroanilino)benzoic acid CAS Name: 5-azido-2-(4-nitroanilino)benzoic acid IUPAC Name: 5-azido-2-(4-nitroanilino)benzoic acid Traditional Name: 5-azido-2-(4-nitroanilino)benzoic acid Formula: C13H9N5O4 MolecularWeight: 299.24166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C(C=C(C=C2)N=[N+]=[N-])C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC2=C(C=C(C=C2)N=[N+]=[N-])C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H9N5O4/c14-17-16-9-3-6-12(11(7-9)13(19)20)15-8-1-4-10(5-2-8)18(21)22/h1-7,15H,(H,19,20)