(3-chloranyl-1-benzothiophen-2-yl)methyl 2-fluoranyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 2-fluoranyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 2-fluoro-5-morpholinosulfonyl-benzoate CAS Name: 2-fluoro-5-(4-morpholinylsulfonyl)benzoic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 2-fluoro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-fluoro-5-morpholinosulfonyl-benzoic acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C20H17ClFNO5S2 MolecularWeight: 469.934083

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)OCC3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)OCC3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C20H17ClFNO5S2/c21-19-14-3-1-2-4-17(14)29-18(19)12-28-20(24)15-11-13(5-6-16(15)22)30(25,26)23-7-9-27-10-8-23/h1-6,11H,7-10,12H2