[2-(4-chlorophenyl)-5-methyl-pyrazol-3-yl] 4-(oxolan-2-ylmethoxy)benzoate

Systemtic Name: [2-(4-chlorophenyl)-5-methyl-pyrazol-3-yl] 4-(oxolan-2-ylmethoxy)benzoate Openeye Name: [2-(4-chlorophenyl)-5-methyl-pyrazol-3-yl] 4-(tetrahydrofuran-2-ylmethoxy)benzoate CAS Name: 4-(2-oxolanylmethoxy)benzoic acid [2-(4-chlorophenyl)-5-methyl-3-pyrazolyl] ester IUPAC Name: [2-(4-chlorophenyl)-5-methylpyrazol-3-yl] 4-(oxolan-2-ylmethoxy)benzoate Traditional Name: 4-(tetrahydrofurfuryloxy)benzoic acid [2-(4-chlorophenyl)-5-methyl-pyrazol-3-yl] ester Formula: C22H21ClN2O4 MolecularWeight: 412.86614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)OC(=O)C2=CC=C(C=C2)OCC3CCCO3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NN(C(=C1)OC(=O)C2=CC=C(C=C2)OCC3CCCO3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H21ClN2O4/c1-15-13-21(25(24-15)18-8-6-17(23)7-9-18)29-22(26)16-4-10-19(11-5-16)28-14-20-3-2-12-27-20/h4-11,13,20H,2-3,12,14H2,1H3