(2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 4-azanyl-3-nitro-benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 4-azanyl-3-nitro-benzoate Openeye Name: (2-morpholino-2-oxo-1-phenyl-ethyl) 4-amino-3-nitro-benzoate CAS Name: 4-amino-3-nitrobenzoic acid [2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxo-1-phenylethyl) 4-amino-3-nitrobenzoate Traditional Name: 4-amino-3-nitro-benzoic acid (2-keto-2-morpholino-1-phenyl-ethyl) ester Formula: C19H19N3O6 MolecularWeight: 385.37066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O6/c20-15-7-6-14(12-16(15)22(25)26)19(24)28-17(13-4-2-1-3-5-13)18(23)21-8-10-27-11-9-21/h1-7,12,17H,8-11,20H2