(2-chloranyl-6-fluoranyl-phenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid (2-chloro-6-fluoro-benzyl) ester Formula: C18H17ClFNO4S MolecularWeight: 397.848283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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