(3-chlorophenyl)methyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (3-chlorophenyl)methyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (3-chlorophenyl)methyl 4-bromo-3-morpholinosulfonyl-benzoate CAS Name: 4-bromo-3-(4-morpholinylsulfonyl)benzoic acid (3-chlorophenyl)methyl ester IUPAC Name: (3-chlorophenyl)methyl 4-bromo-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-bromo-3-morpholinosulfonyl-benzoic acid (3-chlorobenzyl) ester Formula: C18H17BrClNO5S MolecularWeight: 474.75328

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC(=CC=C3)Cl)Br

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC(=CC=C3)Cl)Br

InChI

InChI=1S/C18H17BrClNO5S/c19-16-5-4-14(18(22)26-12-13-2-1-3-15(20)10-13)11-17(16)27(23,24)21-6-8-25-9-7-21/h1-5,10-11H,6-9,12H2