(2-chloranyl-4-fluoranyl-phenyl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: (2-chloro-4-fluoro-phenyl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid (2-chloro-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-fluorophenyl)methyl 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid (2-chloro-4-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=C(C=C3)F)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=C(C=C(C=C3)F)Cl

InChI

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