[5,5-bis(ethylsulfanyl)-2,3,4-tris(oxidanyl)pentyl] benzoate

Systemtic Name: [5,5-bis(ethylsulfanyl)-2,3,4-tris(oxidanyl)pentyl] benzoate Openeye Name: [5,5-bis(ethylsulfanyl)-2,3,4-trihydroxy-pentyl] benzoate CAS Name: benzoic acid [5,5-bis(ethylthio)-2,3,4-trihydroxypentyl] ester IUPAC Name: [5,5-bis(ethylsulfanyl)-2,3,4-trihydroxypentyl] benzoate Traditional Name: benzoic acid [5,5-bis(ethylthio)-2,3,4-trihydroxy-pentyl] ester Formula: C16H24O5S2 MolecularWeight: 360.48876

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C(C(C(COC(=O)C1=CC=CC=C1)O)O)O)SCC

Isomeric SMILES

CCSC(C(C(C(COC(=O)C1=CC=CC=C1)O)O)O)SCC

InChI

InChI=1S/C16H24O5S2/c1-3-22-16(23-4-2)14(19)13(18)12(17)10-21-15(20)11-8-6-5-7-9-11/h5-9,12-14,16-19H,3-4,10H2,1-2H3