(2-naphthalen-2-ylquinolin-4-yl) 4-methylbenzenesulfonate

Systemtic Name: (2-naphthalen-2-ylquinolin-4-yl) 4-methylbenzenesulfonate Openeye Name: [2-(2-naphthyl)-4-quinolyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(2-naphthalenyl)-4-quinolinyl] ester IUPAC Name: (2-naphthalen-2-ylquinolin-4-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(2-naphthyl)-4-quinolyl] ester Formula: C26H19NO3S MolecularWeight: 425.49896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=NC3=CC=CC=C32)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=NC3=CC=CC=C32)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H19NO3S/c1-18-10-14-22(15-11-18)31(28,29)30-26-17-25(27-24-9-5-4-8-23(24)26)21-13-12-19-6-2-3-7-20(19)16-21/h2-17H,1H3