2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]ethanoic acid

Systemtic Name: 2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]ethanoic acid Openeye Name: 2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)acetic acid CAS Name: 2-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]acetic acid IUPAC Name: 2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]acetic acid Traditional Name: 2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)acetic acid Formula: C11H18N2O2 MolecularWeight: 210.27282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CC(=O)O

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CC(=O)O

InChI

InChI=1S/C11H18N2O2/c1-7(2)6-13-9(4)10(5-11(14)15)8(3)12-13/h7H,5-6H2,1-4H3,(H,14,15)