ethyl 4-[2-[(2-bromanyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(2-bromanyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(2-bromo-4-nitro-anilino)-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-(2-bromo-4-nitroanilino)-2-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-bromo-4-nitroanilino)-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[2-(2-bromo-4-nitro-anilino)-2-keto-ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H19BrN4O5 MolecularWeight: 415.23916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C15H19BrN4O5/c1-2-25-15(22)19-7-5-18(6-8-19)10-14(21)17-13-4-3-11(20(23)24)9-12(13)16/h3-4,9H,2,5-8,10H2,1H3,(H,17,21)