tert-butyl 4-azanyl-3-(2,4-dimethylphenyl)-5-ethyl-pyrazole-1-carboxylate

Systemtic Name: tert-butyl 4-azanyl-3-(2,4-dimethylphenyl)-5-ethyl-pyrazole-1-carboxylate Openeye Name: tert-butyl 4-amino-3-(2,4-dimethylphenyl)-5-ethyl-pyrazole-1-carboxylate CAS Name: 4-amino-3-(2,4-dimethylphenyl)-5-ethyl-1-pyrazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-amino-3-(2,4-dimethylphenyl)-5-ethylpyrazole-1-carboxylate Traditional Name: 4-amino-3-(2,4-dimethylphenyl)-5-ethyl-pyrazole-1-carboxylic acid tert-butyl ester Formula: C18H25N3O2 MolecularWeight: 315.41

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C(=O)OC(C)(C)C)C2=C(C=C(C=C2)C)C)N

Isomeric SMILES

CCC1=C(C(=NN1C(=O)OC(C)(C)C)C2=C(C=C(C=C2)C)C)N

InChI

InChI=1S/C18H25N3O2/c1-7-14-15(19)16(13-9-8-11(2)10-12(13)3)20-21(14)17(22)23-18(4,5)6/h8-10H,7,19H2,1-6H3