tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(3-oxidanylidene-1,2-dihydropyrazol-4-yl)butanoate

Systemtic Name: tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(3-oxidanylidene-1,2-dihydropyrazol-4-yl)butanoate Openeye Name: tert-butyl 2-(tert-butoxycarbonylamino)-4-(3-oxo-1,2-dihydropyrazol-4-yl)butanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(3-oxo-1,2-dihydropyrazol-4-yl)butanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(3-oxo-1,2-dihydropyrazol-4-yl)butanoate Traditional Name: 2-(tert-butoxycarbonylamino)-4-(3-keto-3-pyrazolin-4-yl)butyric acid tert-butyl ester Formula: C16H27N3O5 MolecularWeight: 341.40268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCC1=CNNC1=O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(CCC1=CNNC1=O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H27N3O5/c1-15(2,3)23-13(21)11(18-14(22)24-16(4,5)6)8-7-10-9-17-19-12(10)20/h9,11H,7-8H2,1-6H3,(H,18,22)(H2,17,19,20)