11-oxidanylidene-12-oxabicyclo[11.4.0]heptadeca-1(13),14,16-triene-14-sulfonate

Systemtic Name: 11-oxidanylidene-12-oxabicyclo[11.4.0]heptadeca-1(13),14,16-triene-14-sulfonate Openeye Name: 11-oxo-12-oxabicyclo[11.4.0]heptadeca-1(13),14,16-triene-14-sulfonate CAS Name: 11-oxo-12-oxabicyclo[11.4.0]heptadeca-1(13),14,16-triene-14-sulfonate IUPAC Name: 11-oxo-12-oxabicyclo[11.4.0]heptadeca-1(13),14,16-triene-14-sulfonate Traditional Name: 11-keto-12-oxabicyclo[11.4.0]heptadeca-1(13),14,16-triene-14-sulfonate Formula: C16H21O5S- MolecularWeight: 325.39994

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC2=C(C(=CC=C2)S(=O)(=O)[O-])OC(=O)CCCC1

Isomeric SMILES

C1CCCCC2=C(C(=CC=C2)S(=O)(=O)[O-])OC(=O)CCCC1

InChI

InChI=1S/C16H22O5S/c17-15-12-7-5-3-1-2-4-6-9-13-10-8-11-14(16(13)21-15)22(18,19)20/h8,10-11H,1-7,9,12H2,(H,18,19,20)/p-1