ethyl 4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)-1-(4-nitrophenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)-1-(4-nitrophenyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-(2-morpholino-2-oxo-ethoxy)-1-(4-nitrophenyl)pyrazole-3-carboxylate CAS Name: 4-[2-(4-morpholinyl)-2-oxoethoxy]-1-(4-nitrophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-morpholin-4-yl-2-oxoethoxy)-1-(4-nitrophenyl)pyrazole-3-carboxylate Traditional Name: 4-(2-keto-2-morpholino-ethoxy)-1-(4-nitrophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C18H20N4O7 MolecularWeight: 404.374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1OCC(=O)N2CCOCC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C=C1OCC(=O)N2CCOCC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O7/c1-2-28-18(24)17-15(29-12-16(23)20-7-9-27-10-8-20)11-21(19-17)13-3-5-14(6-4-13)22(25)26/h3-6,11H,2,7-10,12H2,1H3