O3-tert-butyl O2-(phenylmethyl) 3,4-dihydropyrazole-2,3-dicarboxylate

Systemtic Name: O3-tert-butyl O2-(phenylmethyl) 3,4-dihydropyrazole-2,3-dicarboxylate Openeye Name: O2-benzyl O3-tert-butyl 3,4-dihydropyrazole-2,3-dicarboxylate CAS Name: 3,4-dihydropyrazole-2,3-dicarboxylic acid O3-tert-butyl ester O2-(phenylmethyl) ester IUPAC Name: 2-O-benzyl 3-O-tert-butyl 3,4-dihydropyrazole-2,3-dicarboxylate Traditional Name: 2-pyrazoline-1,5-dicarboxylic acid O1-benzyl ester O5-tert-butyl ester Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CC=NN1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C1CC=NN1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H20N2O4/c1-16(2,3)22-14(19)13-9-10-17-18(13)15(20)21-11-12-7-5-4-6-8-12/h4-8,10,13H,9,11H2,1-3H3