(2,2,4-trimethyl-1H-quinolin-6-yl) naphthalene-2-sulfonate

Systemtic Name: (2,2,4-trimethyl-1H-quinolin-6-yl) naphthalene-2-sulfonate Openeye Name: (2,2,4-trimethyl-1H-quinolin-6-yl) naphthalene-2-sulfonate CAS Name: 2-naphthalenesulfonic acid (2,2,4-trimethyl-1H-quinolin-6-yl) ester IUPAC Name: (2,2,4-trimethyl-1H-quinolin-6-yl) naphthalene-2-sulfonate Traditional Name: naphthalene-2-sulfonic acid (2,2,4-trimethyl-1H-quinolin-6-yl) ester Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NC2=C1C=C(C=C2)OS(=O)(=O)C3=CC4=CC=CC=C4C=C3)(C)C

Isomeric SMILES

CC1=CC(NC2=C1C=C(C=C2)OS(=O)(=O)C3=CC4=CC=CC=C4C=C3)(C)C

InChI

InChI=1S/C22H21NO3S/c1-15-14-22(2,3)23-21-11-9-18(13-20(15)21)26-27(24,25)19-10-8-16-6-4-5-7-17(16)12-19/h4-14,23H,1-3H3