[5-methyl-2-phenyl-4-(phenylsulfonyl)pyrazol-3-yl] 2-chloranylbenzoate

Systemtic Name: [5-methyl-2-phenyl-4-(phenylsulfonyl)pyrazol-3-yl] 2-chloranylbenzoate Openeye Name: [4-(benzenesulfonyl)-5-methyl-2-phenyl-pyrazol-3-yl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [4-(benzenesulfonyl)-5-methyl-2-phenyl-3-pyrazolyl] ester IUPAC Name: [4-(benzenesulfonyl)-5-methyl-2-phenylpyrazol-3-yl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid (4-besyl-5-methyl-2-phenyl-pyrazol-3-yl) ester Formula: C23H17ClN2O4S MolecularWeight: 452.91008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H17ClN2O4S/c1-16-21(31(28,29)18-12-6-3-7-13-18)22(26(25-16)17-10-4-2-5-11-17)30-23(27)19-14-8-9-15-20(19)24/h2-15H,1H3