propan-2-yl 4-(3-nitrophenyl)-5-oxidanylidene-3-propan-2-yloxy-1,2,4-triazole-1-carboxylate

Systemtic Name: propan-2-yl 4-(3-nitrophenyl)-5-oxidanylidene-3-propan-2-yloxy-1,2,4-triazole-1-carboxylate Openeye Name: isopropyl 3-isopropoxy-4-(3-nitrophenyl)-5-oxo-1,2,4-triazole-1-carboxylate CAS Name: 4-(3-nitrophenyl)-5-oxo-3-propan-2-yloxy-1,2,4-triazole-1-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(3-nitrophenyl)-5-oxo-3-propan-2-yloxy-1,2,4-triazole-1-carboxylate Traditional Name: 3-isopropoxy-5-keto-4-(3-nitrophenyl)-1,2,4-triazole-1-carboxylic acid isopropyl ester Formula: C15H18N4O6 MolecularWeight: 350.32662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NN(C(=O)N1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C

Isomeric SMILES

CC(C)OC1=NN(C(=O)N1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)C

InChI

InChI=1S/C15H18N4O6/c1-9(2)24-13-16-18(15(21)25-10(3)4)14(20)17(13)11-6-5-7-12(8-11)19(22)23/h5-10H,1-4H3