quinolin-8-yl 2,5-dimethylbenzenesulfonate

Systemtic Name: quinolin-8-yl 2,5-dimethylbenzenesulfonate Openeye Name: 8-quinolyl 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid 8-quinolyl ester Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C17H15NO3S/c1-12-8-9-13(2)16(11-12)22(19,20)21-15-7-3-5-14-6-4-10-18-17(14)15/h3-11H,1-2H3