(4-nitrophenyl)methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-propan-2-yl-1,2-dihydropyrazole-3-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-propan-2-yl-1,2-dihydropyrazole-3-carboxylate Openeye Name: (4-nitrophenyl)methyl 3-(tert-butoxycarbonylamino)-5-isopropyl-1,2-dihydropyrazole-3-carboxylate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-propan-2-yl-1,2-dihydropyrazole-3-carboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]-5-propan-2-yl-1,2-dihydropyrazole-3-carboxylate Traditional Name: 3-(tert-butoxycarbonylamino)-5-isopropyl-3-pyrazoline-3-carboxylic acid (4-nitrobenzyl) ester Formula: C19H26N4O6 MolecularWeight: 406.43294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(NN1)(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C1=CC(NN1)(C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H26N4O6/c1-12(2)15-10-19(22-21-15,20-17(25)29-18(3,4)5)16(24)28-11-13-6-8-14(9-7-13)23(26)27/h6-10,12,21-22H,11H2,1-5H3,(H,20,25)