(4-oxidanylidenecyclohexyl) 1-phenyl-5-propan-2-yl-pyrazole-4-carboxylate

Systemtic Name: (4-oxidanylidenecyclohexyl) 1-phenyl-5-propan-2-yl-pyrazole-4-carboxylate Openeye Name: (4-oxocyclohexyl) 5-isopropyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 1-phenyl-5-propan-2-yl-4-pyrazolecarboxylic acid (4-oxocyclohexyl) ester IUPAC Name: (4-oxocyclohexyl) 1-phenyl-5-propan-2-ylpyrazole-4-carboxylate Traditional Name: 5-isopropyl-1-phenyl-pyrazole-4-carboxylic acid (4-ketocyclohexyl) ester Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=NN1C2=CC=CC=C2)C(=O)OC3CCC(=O)CC3

Isomeric SMILES

CC(C)C1=C(C=NN1C2=CC=CC=C2)C(=O)OC3CCC(=O)CC3

InChI

InChI=1S/C19H22N2O3/c1-13(2)18-17(12-20-21(18)14-6-4-3-5-7-14)19(23)24-16-10-8-15(22)9-11-16/h3-7,12-13,16H,8-11H2,1-2H3