[4-(4-fluorophenyl)carbonylphenyl] 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: [4-(4-fluorophenyl)carbonylphenyl] 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: [4-(4-fluorobenzoyl)phenyl] 4-chloro-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-chloro-3-(1-pyrrolidinylsulfonyl)benzoic acid [4-[(4-fluorophenyl)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-fluorobenzoyl)phenyl] 4-chloro-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-pyrrolidinosulfonyl-benzoic acid [4-(4-fluorobenzoyl)phenyl] ester Formula: C24H19ClFNO5S MolecularWeight: 487.927763

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)F)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)F)Cl

InChI

InChI=1S/C24H19ClFNO5S/c25-21-12-7-18(15-22(21)33(30,31)27-13-1-2-14-27)24(29)32-20-10-5-17(6-11-20)23(28)16-3-8-19(26)9-4-16/h3-12,15H,1-2,13-14H2