(2-methylphenyl) 6-methylquinoline-5-sulfonate

Systemtic Name: (2-methylphenyl) 6-methylquinoline-5-sulfonate Openeye Name: o-tolyl 6-methylquinoline-5-sulfonate CAS Name: 6-methyl-5-quinolinesulfonic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 6-methylquinoline-5-sulfonate Traditional Name: 6-methylquinoline-5-sulfonic acid o-tolyl ester Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N=CC=C2)S(=O)(=O)OC3=CC=CC=C3C

Isomeric SMILES

CC1=C(C2=C(C=C1)N=CC=C2)S(=O)(=O)OC3=CC=CC=C3C

InChI

InChI=1S/C17H15NO3S/c1-12-6-3-4-8-16(12)21-22(19,20)17-13(2)9-10-15-14(17)7-5-11-18-15/h3-11H,1-2H3