methyl 4-[5-(4-fluorosulfonylphenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]benzoate

Systemtic Name: methyl 4-[5-(4-fluorosulfonylphenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]benzoate Openeye Name: methyl 4-[5-(4-fluorosulfonylphenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]benzoate CAS Name: 4-[5-(4-fluorosulfonylphenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-(4-fluorosulfonylphenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]benzoate Traditional Name: 4-[3-(4-fluorosulfonylphenyl)-5-phenyl-2-pyrazolin-1-yl]benzoic acid methyl ester Formula: C23H19FN2O4S MolecularWeight: 438.471363

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N2C(CC(=N2)C3=CC=C(C=C3)S(=O)(=O)F)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2C(CC(=N2)C3=CC=C(C=C3)S(=O)(=O)F)C4=CC=CC=C4

InChI

InChI=1S/C23H19FN2O4S/c1-30-23(27)18-7-11-19(12-8-18)26-22(17-5-3-2-4-6-17)15-21(25-26)16-9-13-20(14-10-16)31(24,28)29/h2-14,22H,15H2,1H3