(2-methylphenyl) 4-methylnaphthalene-1-sulfonate

Systemtic Name: (2-methylphenyl) 4-methylnaphthalene-1-sulfonate Openeye Name: o-tolyl 4-methylnaphthalene-1-sulfonate CAS Name: 4-methyl-1-naphthalenesulfonic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 4-methylnaphthalene-1-sulfonate Traditional Name: 4-methylnaphthalene-1-sulfonic acid o-tolyl ester Formula: C18H16O3S MolecularWeight: 312.38284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OS(=O)(=O)C2=CC=C(C3=CC=CC=C32)C

Isomeric SMILES

CC1=CC=CC=C1OS(=O)(=O)C2=CC=C(C3=CC=CC=C32)C

InChI

InChI=1S/C18H16O3S/c1-13-11-12-18(16-9-5-4-8-15(13)16)22(19,20)21-17-10-6-3-7-14(17)2/h3-12H,1-2H3