oxolan-2-ylmethyl 3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: oxolan-2-ylmethyl 3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: tetrahydrofuran-2-ylmethyl 3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(3-methoxyphenyl)-1-phenyl-4-pyrazolecarboxylic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 3-(3-methoxyphenyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxylic acid tetrahydrofurfuryl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)OCC3CCCO3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)OCC3CCCO3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O4/c1-26-18-10-5-7-16(13-18)21-20(22(25)28-15-19-11-6-12-27-19)14-24(23-21)17-8-3-2-4-9-17/h2-5,7-10,13-14,19H,6,11-12,15H2,1H3