(2-oxidanylidenecyclohexyl) 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: (2-oxidanylidenecyclohexyl) 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate Openeye Name: (2-oxocyclohexyl) 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 3,5-dimethyl-1-phenyl-4-pyrazolecarboxylic acid (2-oxocyclohexyl) ester IUPAC Name: (2-oxocyclohexyl) 3,5-dimethyl-1-phenylpyrazole-4-carboxylate Traditional Name: 3,5-dimethyl-1-phenyl-pyrazole-4-carboxylic acid (2-ketocyclohexyl) ester Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)OC3CCCCC3=O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)OC3CCCCC3=O

InChI

InChI=1S/C18H20N2O3/c1-12-17(18(22)23-16-11-7-6-10-15(16)21)13(2)20(19-12)14-8-4-3-5-9-14/h3-5,8-9,16H,6-7,10-11H2,1-2H3