ethyl 4-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate

Systemtic Name: ethyl 4-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: ethyl 2-(tert-butoxycarbonylamino)-4-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)butanoate CAS Name: 4-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: 2-(tert-butoxycarbonylamino)-4-(3-keto-5-methyl-3-pyrazolin-4-yl)butyric acid ethyl ester Formula: C15H25N3O5 MolecularWeight: 327.3761

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=C(NNC1=O)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CCC1=C(NNC1=O)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C15H25N3O5/c1-6-22-13(20)11(16-14(21)23-15(3,4)5)8-7-10-9(2)17-18-12(10)19/h11H,6-8H2,1-5H3,(H,16,21)(H2,17,18,19)