4-[(2-chloranyl-4,6-dinitro-phenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2-chloranyl-4,6-dinitro-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-chloro-4,6-dinitro-anilino)-4-oxo-butanoic acid CAS Name: 4-(2-chloro-4,6-dinitroanilino)-4-oxobutanoic acid IUPAC Name: 4-(2-chloro-4,6-dinitroanilino)-4-oxobutanoic acid Traditional Name: 4-(2-chloro-4,6-dinitro-anilino)-4-keto-butyric acid Formula: C10H8ClN3O7 MolecularWeight: 317.63942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H8ClN3O7/c11-6-3-5(13(18)19)4-7(14(20)21)10(6)12-8(15)1-2-9(16)17/h3-4H,1-2H2,(H,12,15)(H,16,17)