(2-benzamido-2-oxidanylidene-ethyl) 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: (2-benzamido-2-oxo-ethyl) 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid (2-benzamido-2-keto-ethyl) ester Formula: C20H19N3O7 MolecularWeight: 413.38076

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O7/c24-18(21-19(25)14-4-2-1-3-5-14)13-30-20(26)16-12-15(23(27)28)6-7-17(16)22-8-10-29-11-9-22/h1-7,12H,8-11,13H2,(H,21,24,25)