methyl 3,5-dimethyl-4-pentyl-pyrazole-1-carboxylate

Systemtic Name: methyl 3,5-dimethyl-4-pentyl-pyrazole-1-carboxylate Openeye Name: methyl 3,5-dimethyl-4-pentyl-pyrazole-1-carboxylate CAS Name: 3,5-dimethyl-4-pentyl-1-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 3,5-dimethyl-4-pentylpyrazole-1-carboxylate Traditional Name: 4-amyl-3,5-dimethyl-pyrazole-1-carboxylic acid methyl ester Formula: C12H20N2O2 MolecularWeight: 224.2994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(N(N=C1C)C(=O)OC)C

Isomeric SMILES

CCCCCC1=C(N(N=C1C)C(=O)OC)C

InChI

InChI=1S/C12H20N2O2/c1-5-6-7-8-11-9(2)13-14(10(11)3)12(15)16-4/h5-8H2,1-4H3