[8-oxidanyl-5,11-bis(oxidanylidene)spiro[5.5]undecan-10-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [8-oxidanyl-5,11-bis(oxidanylidene)spiro[5.5]undecan-10-yl]methyl 4-methylbenzenesulfonate Openeye Name: (8-hydroxy-5,11-dioxo-spiro[5.5]undecan-10-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (8-hydroxy-5,11-dioxo-10-spiro[5.5]undecanyl)methyl ester IUPAC Name: (8-hydroxy-5,11-dioxospiro[5.5]undecan-10-yl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (8-hydroxy-5,11-diketo-spiro[5.5]undecan-10-yl)methyl ester Formula: C19H24O6S MolecularWeight: 380.45526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CC(CC3(C2=O)CCCCC3=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CC(CC3(C2=O)CCCCC3=O)O

InChI

InChI=1S/C19H24O6S/c1-13-5-7-16(8-6-13)26(23,24)25-12-14-10-15(20)11-19(18(14)22)9-3-2-4-17(19)21/h5-8,14-15,20H,2-4,9-12H2,1H3