(2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 2-chloranyl-5-nitro-benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 2-chloranyl-5-nitro-benzoate Openeye Name: (2-morpholino-2-oxo-1-phenyl-ethyl) 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid [2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxo-1-phenylethyl) 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid (2-keto-2-morpholino-1-phenyl-ethyl) ester Formula: C19H17ClN2O6 MolecularWeight: 404.80108

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(C2=CC=CC=C2)OC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1COCCN1C(=O)C(C2=CC=CC=C2)OC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H17ClN2O6/c20-16-7-6-14(22(25)26)12-15(16)19(24)28-17(13-4-2-1-3-5-13)18(23)21-8-10-27-11-9-21/h1-7,12,17H,8-11H2