1,3-dimethyl-5-(3-methylbutoxy)pyrazole-4-carboxylic acid

Systemtic Name: 1,3-dimethyl-5-(3-methylbutoxy)pyrazole-4-carboxylic acid Openeye Name: 5-isopentyloxy-1,3-dimethyl-pyrazole-4-carboxylic acid CAS Name: 1,3-dimethyl-5-(3-methylbutoxy)-4-pyrazolecarboxylic acid IUPAC Name: 1,3-dimethyl-5-(3-methylbutoxy)pyrazole-4-carboxylic acid Traditional Name: 5-isoamoxy-1,3-dimethyl-pyrazole-4-carboxylic acid Formula: C11H18N2O3 MolecularWeight: 226.27222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)OCCC(C)C)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)OCCC(C)C)C

InChI

InChI=1S/C11H18N2O3/c1-7(2)5-6-16-10-9(11(14)15)8(3)12-13(10)4/h7H,5-6H2,1-4H3,(H,14,15)