(2-chloranyl-6-fluoranyl-phenyl)methyl 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 4-chloro-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-chloro-3-(1-pyrrolidinylsulfonyl)benzoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 4-chloro-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-pyrrolidinosulfonyl-benzoic acid (2-chloro-6-fluoro-benzyl) ester Formula: C18H16Cl2FNO4S MolecularWeight: 432.293343

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=C(C=CC=C3Cl)F)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=C(C=CC=C3Cl)F)Cl

InChI

InChI=1S/C18H16Cl2FNO4S/c19-14-4-3-5-16(21)13(14)11-26-18(23)12-6-7-15(20)17(10-12)27(24,25)22-8-1-2-9-22/h3-7,10H,1-2,8-9,11H2