(2-methylquinolin-8-yl) 2,4,6-trimethylbenzenesulfonate

Systemtic Name: (2-methylquinolin-8-yl) 2,4,6-trimethylbenzenesulfonate Openeye Name: (2-methyl-8-quinolyl) 2,4,6-trimethylbenzenesulfonate CAS Name: 2,4,6-trimethylbenzenesulfonic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) 2,4,6-trimethylbenzenesulfonate Traditional Name: 2,4,6-trimethylbenzenesulfonic acid (2-methyl-8-quinolyl) ester Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=C(C=C(C=C3C)C)C)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OS(=O)(=O)C3=C(C=C(C=C3C)C)C)C=C1

InChI

InChI=1S/C19H19NO3S/c1-12-10-13(2)19(14(3)11-12)24(21,22)23-17-7-5-6-16-9-8-15(4)20-18(16)17/h5-11H,1-4H3