2-(4-fluorophenyl)-4-[(5-methyl-1H-pyrazol-4-yl)carbonylamino]butanoic acid

Systemtic Name: 2-(4-fluorophenyl)-4-[(5-methyl-1H-pyrazol-4-yl)carbonylamino]butanoic acid Openeye Name: 2-(4-fluorophenyl)-4-[(5-methyl-1H-pyrazole-4-carbonyl)amino]butanoic acid CAS Name: 2-(4-fluorophenyl)-4-[[(5-methyl-1H-pyrazol-4-yl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-(4-fluorophenyl)-4-[(5-methyl-1H-pyrazole-4-carbonyl)amino]butanoic acid Traditional Name: 2-(4-fluorophenyl)-4-[(5-methyl-1H-pyrazole-4-carbonyl)amino]butyric acid Formula: C15H16FN3O3 MolecularWeight: 305.304243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1)C(=O)NCCC(C2=CC=C(C=C2)F)C(=O)O

Isomeric SMILES

CC1=C(C=NN1)C(=O)NCCC(C2=CC=C(C=C2)F)C(=O)O

InChI

InChI=1S/C15H16FN3O3/c1-9-13(8-18-19-9)14(20)17-7-6-12(15(21)22)10-2-4-11(16)5-3-10/h2-5,8,12H,6-7H2,1H3,(H,17,20)(H,18,19)(H,21,22)