ethyl 1-[2-(2-morpholin-4-yl-5-nitro-phenyl)carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(2-morpholin-4-yl-5-nitro-phenyl)carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(2-morpholino-5-nitro-benzoyl)oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[2-(4-morpholinyl)-5-nitrophenyl]-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2-morpholin-4-yl-5-nitrobenzoyl)oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(2-morpholino-5-nitro-benzoyl)oxyacetyl]isonipecotic acid ethyl ester Formula: C21H27N3O8 MolecularWeight: 449.45438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C21H27N3O8/c1-2-31-20(26)15-5-7-23(8-6-15)19(25)14-32-21(27)17-13-16(24(28)29)3-4-18(17)22-9-11-30-12-10-22/h3-4,13,15H,2,5-12,14H2,1H3