[(3R)-2-oxidanylideneoxolan-3-yl] 3-(4-methylphenyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: [(3R)-2-oxidanylideneoxolan-3-yl] 3-(4-methylphenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: [(3R)-2-oxotetrahydrofuran-3-yl] 1-phenyl-3-(p-tolyl)pyrazole-4-carboxylate CAS Name: 3-(4-methylphenyl)-1-phenyl-4-pyrazolecarboxylic acid [(3R)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3R)-2-oxooxolan-3-yl] 3-(4-methylphenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 1-phenyl-3-(p-tolyl)pyrazole-4-carboxylic acid [(3R)-2-ketotetrahydrofuran-3-yl] ester Formula: C21H18N2O4 MolecularWeight: 362.37862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)OC3CCOC3=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)O[C@@H]3CCOC3=O)C4=CC=CC=C4

InChI

InChI=1S/C21H18N2O4/c1-14-7-9-15(10-8-14)19-17(20(24)27-18-11-12-26-21(18)25)13-23(22-19)16-5-3-2-4-6-16/h2-10,13,18H,11-12H2,1H3/t18-/m1/s1