(4-bromanyl-2-chloranyl-6-methyl-phenyl) 2-methyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (4-bromanyl-2-chloranyl-6-methyl-phenyl) 2-methyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (4-bromo-2-chloro-6-methyl-phenyl) 2-methyl-5-morpholinosulfonyl-benzoate CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid (4-bromo-2-chloro-6-methylphenyl) ester IUPAC Name: (4-bromo-2-chloro-6-methylphenyl) 2-methyl-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methyl-5-morpholinosulfonyl-benzoic acid (4-bromo-2-chloro-6-methyl-phenyl) ester Formula: C19H19BrClNO5S MolecularWeight: 488.77986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OC3=C(C=C(C=C3C)Br)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OC3=C(C=C(C=C3C)Br)Cl

InChI

InChI=1S/C19H19BrClNO5S/c1-12-3-4-15(28(24,25)22-5-7-26-8-6-22)11-16(12)19(23)27-18-13(2)9-14(20)10-17(18)21/h3-4,9-11H,5-8H2,1-2H3