ethyl 4-[(4-chloranyl-3-nitro-phenyl)carbamoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(4-chloranyl-3-nitro-phenyl)carbamoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(4-chloro-3-nitro-phenyl)carbamoyl]piperazine-1-carboxylate CAS Name: 4-[(4-chloro-3-nitroanilino)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-chloro-3-nitrophenyl)carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[(4-chloro-3-nitro-phenyl)carbamoyl]piperazine-1-carboxylic acid ethyl ester Formula: C14H17ClN4O5 MolecularWeight: 356.76158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17ClN4O5/c1-2-24-14(21)18-7-5-17(6-8-18)13(20)16-10-3-4-11(15)12(9-10)19(22)23/h3-4,9H,2,5-8H2,1H3,(H,16,20)