2-[4-(2-methylpropyl)-3-phenyl-pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-[4-(2-methylpropyl)-3-phenyl-pyrazol-1-yl]ethanoic acid Openeye Name: 2-(4-isobutyl-3-phenyl-pyrazol-1-yl)acetic acid CAS Name: 2-[4-(2-methylpropyl)-3-phenyl-1-pyrazolyl]acetic acid IUPAC Name: 2-[4-(2-methylpropyl)-3-phenylpyrazol-1-yl]acetic acid Traditional Name: 2-(4-isobutyl-3-phenyl-pyrazol-1-yl)acetic acid Formula: C15H18N2O2 MolecularWeight: 258.31562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CN(N=C1C2=CC=CC=C2)CC(=O)O

Isomeric SMILES

CC(C)CC1=CN(N=C1C2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C15H18N2O2/c1-11(2)8-13-9-17(10-14(18)19)16-15(13)12-6-4-3-5-7-12/h3-7,9,11H,8,10H2,1-2H3,(H,18,19)