[2-(furan-2-ylcarbonylamino)-2-oxidanylidene-ethyl] 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: [2-(furan-2-ylcarbonylamino)-2-oxidanylidene-ethyl] 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: [2-(furan-2-carbonylamino)-2-oxo-ethyl] 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid [2-[[2-furanyl(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(furan-2-carbonylamino)-2-oxoethyl] 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid [2-(2-furoylamino)-2-keto-ethyl] ester Formula: C18H17N3O8 MolecularWeight: 403.34288

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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=CO3

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)NC(=O)C3=CC=CO3

InChI

InChI=1S/C18H17N3O8/c22-16(19-17(23)15-2-1-7-28-15)11-29-18(24)13-10-12(21(25)26)3-4-14(13)20-5-8-27-9-6-20/h1-4,7,10H,5-6,8-9,11H2,(H,19,22,23)