[2-[(4-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [2-[(4-chloranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [2-(4-chloro-2-nitro-anilino)-2-oxo-ethyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [2-(4-chloro-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-2-nitroanilino)-2-oxoethyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [2-(4-chloro-2-nitro-anilino)-2-keto-ethyl] ester Formula: C14H9BrClN3O5 MolecularWeight: 414.59536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)[N+](=O)[O-])NC(=O)COC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

C1=CC(=C(C=C1Cl)[N+](=O)[O-])NC(=O)COC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C14H9BrClN3O5/c15-9-3-8(5-17-6-9)14(21)24-7-13(20)18-11-2-1-10(16)4-12(11)19(22)23/h1-6H,7H2,(H,18,20)