(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate

Systemtic Name: (1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) 5-methyl-2-phenyl-1,2,3-triazole-4-carboxylate Openeye Name: (1-methyl-2-morpholino-2-oxo-ethyl) 5-methyl-2-phenyl-triazole-4-carboxylate CAS Name: 5-methyl-2-phenyl-4-triazolecarboxylic acid [1-(4-morpholinyl)-1-oxopropan-2-yl] ester IUPAC Name: (1-morpholin-4-yl-1-oxopropan-2-yl) 5-methyl-2-phenyltriazole-4-carboxylate Traditional Name: 5-methyl-2-phenyl-triazole-4-carboxylic acid (2-keto-1-methyl-2-morpholino-ethyl) ester Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)OC(C)C(=O)N2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)OC(C)C(=O)N2CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O4/c1-12-15(19-21(18-12)14-6-4-3-5-7-14)17(23)25-13(2)16(22)20-8-10-24-11-9-20/h3-7,13H,8-11H2,1-2H3