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

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: (2-amino-2-oxo-ethyl) 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid (2-amino-2-keto-ethyl) ester Formula: C13H15N3O6 MolecularWeight: 309.2747

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O6/c14-12(17)8-22-13(18)10-7-9(16(19)20)1-2-11(10)15-3-5-21-6-4-15/h1-2,7H,3-6,8H2,(H2,14,17)