ethyl 4-[[4-(4-chloranyl-2-nitro-phenoxy)phenyl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[4-(4-chloranyl-2-nitro-phenoxy)phenyl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[4-(4-chloro-2-nitro-phenoxy)benzoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[4-(4-chloro-2-nitrophenoxy)phenyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(4-chloro-2-nitrophenoxy)benzoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-(4-chloro-2-nitro-phenoxy)benzoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H22ClN3O6 MolecularWeight: 447.86888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H22ClN3O6/c1-2-30-21(27)24-11-9-16(10-12-24)23-20(26)14-3-6-17(7-4-14)31-19-8-5-15(22)13-18(19)25(28)29/h3-8,13,16H,2,9-12H2,1H3,(H,23,26)