quinoxalin-6-yl benzenesulfonate

Systemtic Name: quinoxalin-6-yl benzenesulfonate Openeye Name: quinoxalin-6-yl benzenesulfonate CAS Name: benzenesulfonic acid 6-quinoxalinyl ester IUPAC Name: quinoxalin-6-yl benzenesulfonate Traditional Name: benzenesulfonic acid quinoxalin-6-yl ester Formula: C14H10N2O3S MolecularWeight: 286.3058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=CC3=NC=CN=C3C=C2

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=CC3=NC=CN=C3C=C2

InChI

InChI=1S/C14H10N2O3S/c17-20(18,12-4-2-1-3-5-12)19-11-6-7-13-14(10-11)16-9-8-15-13/h1-10H