4-[1,1-bis(oxidanylidene)-4-(phenylsulfonyl)-2,5-dihydrothiophen-2-yl]butanal

Systemtic Name: 4-[1,1-bis(oxidanylidene)-4-(phenylsulfonyl)-2,5-dihydrothiophen-2-yl]butanal Openeye Name: 4-[4-(benzenesulfonyl)-1,1-dioxo-2,5-dihydrothiophen-2-yl]butanal CAS Name: 4-[4-(benzenesulfonyl)-1,1-dioxo-2,5-dihydrothiophen-2-yl]butanal IUPAC Name: 4-[4-(benzenesulfonyl)-1,1-dioxo-2,5-dihydrothiophen-2-yl]butanal Traditional Name: 4-(4-besyl-1,1-diketo-2,5-dihydrothiophen-2-yl)butyraldehyde Formula: C14H16O5S2 MolecularWeight: 328.40384

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC(S1(=O)=O)CCCC=O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1C(=CC(S1(=O)=O)CCCC=O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H16O5S2/c15-9-5-4-8-13-10-14(11-20(13,16)17)21(18,19)12-6-2-1-3-7-12/h1-3,6-7,9-10,13H,4-5,8,11H2