(2-ethanoyl-4,6-dimethyl-phenyl) 2-methyl-5-propyl-pyrazole-3-carboxylate

Systemtic Name: (2-ethanoyl-4,6-dimethyl-phenyl) 2-methyl-5-propyl-pyrazole-3-carboxylate Openeye Name: (2-acetyl-4,6-dimethyl-phenyl) 2-methyl-5-propyl-pyrazole-3-carboxylate CAS Name: 2-methyl-5-propyl-3-pyrazolecarboxylic acid (2-acetyl-4,6-dimethylphenyl) ester IUPAC Name: (2-acetyl-4,6-dimethylphenyl) 2-methyl-5-propylpyrazole-3-carboxylate Traditional Name: 2-methyl-5-propyl-pyrazole-3-carboxylic acid (2-acetyl-4,6-dimethyl-phenyl) ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1)C(=O)OC2=C(C=C(C=C2C(=O)C)C)C)C

Isomeric SMILES

CCCC1=NN(C(=C1)C(=O)OC2=C(C=C(C=C2C(=O)C)C)C)C

InChI

InChI=1S/C18H22N2O3/c1-6-7-14-10-16(20(5)19-14)18(22)23-17-12(3)8-11(2)9-15(17)13(4)21/h8-10H,6-7H2,1-5H3