7-bicyclo[2.2.1]hepta-1,3,5-trienyl isoquinoline-5-sulfonate

Systemtic Name: 7-bicyclo[2.2.1]hepta-1,3,5-trienyl isoquinoline-5-sulfonate Openeye Name: 7-bicyclo[2.2.1]hepta-1,3,5-trienyl isoquinoline-5-sulfonate CAS Name: 5-isoquinolinesulfonic acid 7-bicyclo[2.2.1]hepta-1,3,5-trienyl ester IUPAC Name: 7-bicyclo[2.2.1]hepta-1,3,5-trienyl isoquinoline-5-sulfonate Traditional Name: isoquinoline-5-sulfonic acid 7-bicyclo[2.2.1]hepta-1,3,5-trienyl ester Formula: C16H11NO3S MolecularWeight: 297.32844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)OC3C4=CC=C3C=C4

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)OC3C4=CC=C3C=C4

InChI

InChI=1S/C16H11NO3S/c18-21(19,20-16-11-4-5-12(16)7-6-11)15-3-1-2-13-10-17-9-8-14(13)15/h1-10,16H