(4-oxidanylidenespiro[3H-chromene-2,1'-cyclohexane]-6-yl) benzenesulfonate

Systemtic Name: (4-oxidanylidenespiro[3H-chromene-2,1'-cyclohexane]-6-yl) benzenesulfonate Openeye Name: (4-oxospiro[chromane-2,1'-cyclohexane]-6-yl) benzenesulfonate CAS Name: benzenesulfonic acid (4-oxo-6-spiro[3,4-dihydro-2H-1-benzopyran-2,1'-cyclohexane]yl) ester IUPAC Name: (4-oxospiro[3H-chromene-2,1'-cyclohexane]-6-yl) benzenesulfonate Traditional Name: benzenesulfonic acid (4-ketospiro[chroman-2,1'-cyclohexane]-6-yl) ester Formula: C20H20O5S MolecularWeight: 372.4348

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)CC(=O)C3=C(O2)C=CC(=C3)OS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC2(CC1)CC(=O)C3=C(O2)C=CC(=C3)OS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H20O5S/c21-18-14-20(11-5-2-6-12-20)24-19-10-9-15(13-17(18)19)25-26(22,23)16-7-3-1-4-8-16/h1,3-4,7-10,13H,2,5-6,11-12,14H2