2-[(4-azanyl-2-nitro-phenyl)amino]-4-chloranyl-benzoic acid

Systemtic Name: 2-[(4-azanyl-2-nitro-phenyl)amino]-4-chloranyl-benzoic acid Openeye Name: 2-(4-amino-2-nitro-anilino)-4-chloro-benzoic acid CAS Name: 2-(4-amino-2-nitroanilino)-4-chlorobenzoic acid IUPAC Name: 2-(4-amino-2-nitroanilino)-4-chlorobenzoic acid Traditional Name: 2-(4-amino-2-nitro-anilino)-4-chloro-benzoic acid Formula: C13H10ClN3O4 MolecularWeight: 307.6892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)[N+](=O)[O-])NC2=C(C=CC(=C2)Cl)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N)[N+](=O)[O-])NC2=C(C=CC(=C2)Cl)C(=O)O

InChI

InChI=1S/C13H10ClN3O4/c14-7-1-3-9(13(18)19)11(5-7)16-10-4-2-8(15)6-12(10)17(20)21/h1-6,16H,15H2,(H,18,19)