4,5-bis(oxidanyl)-2,2-bis(phenylsulfanyl)pentanal

Systemtic Name: 4,5-bis(oxidanyl)-2,2-bis(phenylsulfanyl)pentanal Openeye Name: 4,5-dihydroxy-2,2-bis(phenylsulfanyl)pentanal CAS Name: 4,5-dihydroxy-2,2-bis(phenylthio)pentanal IUPAC Name: 4,5-dihydroxy-2,2-bis(phenylsulfanyl)pentanal Traditional Name: 4,5-dihydroxy-2,2-bis(phenylthio)valeraldehyde Formula: C17H18O3S2 MolecularWeight: 334.45302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC(CC(CO)O)(C=O)SC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)SC(CC(CO)O)(C=O)SC2=CC=CC=C2

InChI

InChI=1S/C17H18O3S2/c18-12-14(20)11-17(13-19,21-15-7-3-1-4-8-15)22-16-9-5-2-6-10-16/h1-10,13-14,18,20H,11-12H2