[4,5-bis(oxidanyl)-6-oxidanylidene-cyclodecyl] benzoate

Systemtic Name: [4,5-bis(oxidanyl)-6-oxidanylidene-cyclodecyl] benzoate Openeye Name: (4,5-dihydroxy-6-oxo-cyclodecyl) benzoate CAS Name: benzoic acid (4,5-dihydroxy-6-oxocyclodecyl) ester IUPAC Name: (4,5-dihydroxy-6-oxocyclodecyl) benzoate Traditional Name: benzoic acid (4,5-dihydroxy-6-keto-cyclodecyl) ester Formula: C17H22O5 MolecularWeight: 306.35358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C(CCC(C1)OC(=O)C2=CC=CC=C2)O)O

Isomeric SMILES

C1CCC(=O)C(C(CCC(C1)OC(=O)C2=CC=CC=C2)O)O

InChI

InChI=1S/C17H22O5/c18-14-9-5-4-8-13(10-11-15(19)16(14)20)22-17(21)12-6-2-1-3-7-12/h1-3,6-7,13,15-16,19-20H,4-5,8-11H2