3-[(1-tert-butylpyrazol-4-yl)methylamino]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[(1-tert-butylpyrazol-4-yl)methylamino]-4-fluoranyl-benzoic acid Openeye Name: 3-[(1-tert-butylpyrazol-4-yl)methylamino]-4-fluoro-benzoic acid CAS Name: 3-[(1-tert-butyl-4-pyrazolyl)methylamino]-4-fluorobenzoic acid IUPAC Name: 3-[(1-tert-butylpyrazol-4-yl)methylamino]-4-fluorobenzoic acid Traditional Name: 3-[(1-tert-butylpyrazol-4-yl)methylamino]-4-fluoro-benzoic acid Formula: C15H18FN3O2 MolecularWeight: 291.320723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C=N1)CNC2=C(C=CC(=C2)C(=O)O)F

Isomeric SMILES

CC(C)(C)N1C=C(C=N1)CNC2=C(C=CC(=C2)C(=O)O)F

InChI

InChI=1S/C15H18FN3O2/c1-15(2,3)19-9-10(8-18-19)7-17-13-6-11(14(20)21)4-5-12(13)16/h4-6,8-9,17H,7H2,1-3H3,(H,20,21)