tert-butyl 4-azanyl-3-(3-fluorophenyl)-5-propyl-pyrazole-1-carboxylate

Systemtic Name: tert-butyl 4-azanyl-3-(3-fluorophenyl)-5-propyl-pyrazole-1-carboxylate Openeye Name: tert-butyl 4-amino-3-(3-fluorophenyl)-5-propyl-pyrazole-1-carboxylate CAS Name: 4-amino-3-(3-fluorophenyl)-5-propyl-1-pyrazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-amino-3-(3-fluorophenyl)-5-propylpyrazole-1-carboxylate Traditional Name: 4-amino-3-(3-fluorophenyl)-5-propyl-pyrazole-1-carboxylic acid tert-butyl ester Formula: C17H22FN3O2 MolecularWeight: 319.373883

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NN1C(=O)OC(C)(C)C)C2=CC(=CC=C2)F)N

Isomeric SMILES

CCCC1=C(C(=NN1C(=O)OC(C)(C)C)C2=CC(=CC=C2)F)N

InChI

InChI=1S/C17H22FN3O2/c1-5-7-13-14(19)15(11-8-6-9-12(18)10-11)20-21(13)16(22)23-17(2,3)4/h6,8-10H,5,7,19H2,1-4H3