(4-bromophenyl) 2-methyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (4-bromophenyl) 2-methyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (4-bromophenyl) 2-methyl-5-morpholinosulfonyl-benzoate CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 2-methyl-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methyl-5-morpholinosulfonyl-benzoic acid (4-bromophenyl) ester Formula: C18H18BrNO5S MolecularWeight: 440.30822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H18BrNO5S/c1-13-2-7-16(26(22,23)20-8-10-24-11-9-20)12-17(13)18(21)25-15-5-3-14(19)4-6-15/h2-7,12H,8-11H2,1H3