(2-chloranyl-6-fluoranyl-phenyl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (2-chloro-6-fluoro-benzyl) ester Formula: C18H17ClFNO4S MolecularWeight: 397.848283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClFNO4S/c19-16-7-4-8-17(20)15(16)12-25-18(22)13-5-3-6-14(11-13)26(23,24)21-9-1-2-10-21/h3-8,11H,1-2,9-10,12H2