(5-methyl-2-propan-2-yl-phenyl) 5-bromanyl-6-chloranyl-pyridine-3-sulfonate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) 5-bromanyl-6-chloranyl-pyridine-3-sulfonate Openeye Name: (2-isopropyl-5-methyl-phenyl) 5-bromo-6-chloro-pyridine-3-sulfonate CAS Name: 5-bromo-6-chloro-3-pyridinesulfonic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) 5-bromo-6-chloropyridine-3-sulfonate Traditional Name: 5-bromo-6-chloro-pyridine-3-sulfonic acid (2-isopropyl-5-methyl-phenyl) ester Formula: C15H15BrClNO3S MolecularWeight: 404.7065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OS(=O)(=O)C2=CC(=C(N=C2)Cl)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OS(=O)(=O)C2=CC(=C(N=C2)Cl)Br

InChI

InChI=1S/C15H15BrClNO3S/c1-9(2)12-5-4-10(3)6-14(12)21-22(19,20)11-7-13(16)15(17)18-8-11/h4-9H,1-3H3