(2-chloranyl-4-fluoranyl-phenyl)methyl 2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (2-chloro-4-fluoro-phenyl)methyl 2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 2-chloro-5-(1-pyrrolidinylsulfonyl)benzoic acid (2-chloro-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-fluorophenyl)methyl 2-chloro-5-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-pyrrolidinosulfonyl-benzoic acid (2-chloro-4-fluoro-benzyl) ester Formula: C18H16Cl2FNO4S MolecularWeight: 432.293343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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