(4-methylphenyl) 4-bromanylnaphthalene-1-sulfonate

Systemtic Name: (4-methylphenyl) 4-bromanylnaphthalene-1-sulfonate Openeye Name: p-tolyl 4-bromonaphthalene-1-sulfonate CAS Name: 4-bromo-1-naphthalenesulfonic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 4-bromonaphthalene-1-sulfonate Traditional Name: 4-bromonaphthalene-1-sulfonic acid p-tolyl ester Formula: C17H13BrO3S MolecularWeight: 377.25232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C3=CC=CC=C32)Br

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C3=CC=CC=C32)Br

InChI

InChI=1S/C17H13BrO3S/c1-12-6-8-13(9-7-12)21-22(19,20)17-11-10-16(18)14-4-2-3-5-15(14)17/h2-11H,1H3