2,6-diphenylcyclohexa-1,5-diene-1-sulfonate

Systemtic Name: 2,6-diphenylcyclohexa-1,5-diene-1-sulfonate Openeye Name: 2,6-diphenylcyclohexa-1,5-diene-1-sulfonate CAS Name: 2,6-diphenyl-1-cyclohexa-1,5-dienesulfonate IUPAC Name: 2,6-diphenylcyclohexa-1,5-diene-1-sulfonate Traditional Name: 2,6-diphenylcyclohexa-1,5-diene-1-sulfonate Formula: C18H15O3S- MolecularWeight: 311.3749

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C(=C1)C2=CC=CC=C2)S(=O)(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1CC(=C(C(=C1)C2=CC=CC=C2)S(=O)(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H16O3S/c19-22(20,21)18-16(14-8-3-1-4-9-14)12-7-13-17(18)15-10-5-2-6-11-15/h1-6,8-12H,7,13H2,(H,19,20,21)/p-1