4-[4-oxidanyl-2,2-bis(oxidanylidene)-1,2$l^{6}-benzoxathiin-3-yl]-4-phenyl-butan-2-one

Systemtic Name: 4-[4-oxidanyl-2,2-bis(oxidanylidene)-1,2$l^{6}-benzoxathiin-3-yl]-4-phenyl-butan-2-one Openeye Name: 4-(4-hydroxy-2,2-dioxo-1,2$l^{6}-benzoxathiin-3-yl)-4-phenyl-butan-2-one CAS Name: 4-(4-hydroxy-2,2-dioxo-1,2$l^{6}-benzoxathiin-3-yl)-4-phenyl-2-butanone IUPAC Name: 4-(4-hydroxy-2,2-dioxo-1,2$l^{6}-benzoxathiin-3-yl)-4-phenylbutan-2-one Traditional Name: 4-(4-hydroxy-2,2-diketo-1,2$l^{6}-benzoxathiin-3-yl)-4-phenyl-butan-2-one Formula: C18H16O5S MolecularWeight: 344.38164

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OS2(=O)=O)O

Isomeric SMILES

CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OS2(=O)=O)O

InChI

InChI=1S/C18H16O5S/c1-12(19)11-15(13-7-3-2-4-8-13)18-17(20)14-9-5-6-10-16(14)23-24(18,21)22/h2-10,15,20H,11H2,1H3