dimethyl 5-(tert-butylamino)-1-phenyl-pyrazole-3,4-dicarboxylate

Systemtic Name: dimethyl 5-(tert-butylamino)-1-phenyl-pyrazole-3,4-dicarboxylate Openeye Name: dimethyl 5-(tert-butylamino)-1-phenyl-pyrazole-3,4-dicarboxylate CAS Name: 5-(tert-butylamino)-1-phenylpyrazole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(tert-butylamino)-1-phenylpyrazole-3,4-dicarboxylate Traditional Name: 5-(tert-butylamino)-1-phenyl-pyrazole-3,4-dicarboxylic acid dimethyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(C(=NN1C2=CC=CC=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)NC1=C(C(=NN1C2=CC=CC=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H21N3O4/c1-17(2,3)18-14-12(15(21)23-4)13(16(22)24-5)19-20(14)11-9-7-6-8-10-11/h6-10,18H,1-5H3