sodium 8-(4-methylphenyl)sulfonyloxyquinolin-4-olate

Systemtic Name: sodium 8-(4-methylphenyl)sulfonyloxyquinolin-4-olate Openeye Name: sodium 8-(p-tolylsulfonyloxy)quinolin-4-olate CAS Name: sodium 8-(4-methylphenyl)sulfonyloxy-4-quinolinolate IUPAC Name: sodium 8-(4-methylphenyl)sulfonyloxyquinolin-4-olate Traditional Name: sodium 8-tosyloxyquinolin-4-olate Formula: C16H12NNaO4S MolecularWeight: 337.32555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C(C=CN=C32)[O-].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C(C=CN=C32)[O-].[Na+]

InChI

InChI=1S/C16H13NO4S.Na/c1-11-5-7-12(8-6-11)22(19,20)21-15-4-2-3-13-14(18)9-10-17-16(13)15;/h2-10H,1H3,(H,17,18);/q;+1/p-1