ethyl 4-(3-ethoxycarbonyl-5-nitro-phenyl)carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(3-ethoxycarbonyl-5-nitro-phenyl)carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(3-ethoxycarbonyl-5-nitro-benzoyl)piperazine-1-carboxylate CAS Name: 4-[(3-ethoxycarbonyl-5-nitrophenyl)-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-ethoxycarbonyl-5-nitrobenzoyl)piperazine-1-carboxylate Traditional Name: 4-(3-carbethoxy-5-nitro-benzoyl)piperazine-1-carboxylic acid ethyl ester Formula: C17H21N3O7 MolecularWeight: 379.36454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCN(CC2)C(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)N2CCN(CC2)C(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O7/c1-3-26-16(22)13-9-12(10-14(11-13)20(24)25)15(21)18-5-7-19(8-6-18)17(23)27-4-2/h9-11H,3-8H2,1-2H3