[4-[3-(4-fluoranylphenoxy)propanoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [4-[3-(4-fluoranylphenoxy)propanoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate Openeye Name: [4-[3-(4-fluorophenoxy)propanoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[[3-(4-fluorophenoxy)-1-oxopropyl]amino]-1-pyrazolyl]methyl ester IUPAC Name: [4-[3-(4-fluorophenoxy)propanoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[3-(4-fluorophenoxy)propanoylamino]pyrazol-1-yl]methyl ester Formula: C18H22FN3O4 MolecularWeight: 363.383383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=C(C=N1)NC(=O)CCOC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=C(C=N1)NC(=O)CCOC2=CC=C(C=C2)F

InChI

InChI=1S/C18H22FN3O4/c1-18(2,3)17(24)26-12-22-11-14(10-20-22)21-16(23)8-9-25-15-6-4-13(19)5-7-15/h4-7,10-11H,8-9,12H2,1-3H3,(H,21,23)