(2-methylquinolin-8-yl) benzenesulfonate

Systemtic Name: (2-methylquinolin-8-yl) benzenesulfonate Openeye Name: (2-methyl-8-quinolyl) benzenesulfonate CAS Name: benzenesulfonic acid (2-methyl-8-quinolinyl) ester IUPAC Name: (2-methylquinolin-8-yl) benzenesulfonate Traditional Name: benzenesulfonic acid (2-methyl-8-quinolyl) ester Formula: C16H13NO3S MolecularWeight: 299.34432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO3S/c1-12-10-11-13-6-5-9-15(16(13)17-12)20-21(18,19)14-7-3-2-4-8-14/h2-11H,1H3