ethyl 1-(2-ethoxy-2-oxidanylidene-ethyl)-4-morpholin-4-yl-5-phenyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(2-ethoxy-2-oxidanylidene-ethyl)-4-morpholin-4-yl-5-phenyl-pyrazole-3-carboxylate Openeye Name: ethyl 1-(2-ethoxy-2-oxo-ethyl)-4-morpholino-5-phenyl-pyrazole-3-carboxylate CAS Name: 1-(2-ethoxy-2-oxoethyl)-4-(4-morpholinyl)-5-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-ethoxy-2-oxoethyl)-4-morpholin-4-yl-5-phenylpyrazole-3-carboxylate Traditional Name: 1-(2-ethoxy-2-keto-ethyl)-4-morpholino-5-phenyl-pyrazole-3-carboxylic acid ethyl ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=C(C(=N1)C(=O)OCC)N2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN1C(=C(C(=N1)C(=O)OCC)N2CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C20H25N3O5/c1-3-27-16(24)14-23-18(15-8-6-5-7-9-15)19(22-10-12-26-13-11-22)17(21-23)20(25)28-4-2/h5-9H,3-4,10-14H2,1-2H3