2-[2-(1,3-dioxan-2-yl)ethyl]-9-oxidanyl-10-phenylsulfanyl-3,4-dihydro-2H-anthracen-1-one

Systemtic Name: 2-[2-(1,3-dioxan-2-yl)ethyl]-9-oxidanyl-10-phenylsulfanyl-3,4-dihydro-2H-anthracen-1-one Openeye Name: 2-[2-(1,3-dioxan-2-yl)ethyl]-9-hydroxy-10-phenylsulfanyl-3,4-dihydro-2H-anthracen-1-one CAS Name: 2-[2-(1,3-dioxan-2-yl)ethyl]-9-hydroxy-10-(phenylthio)-3,4-dihydro-2H-anthracen-1-one IUPAC Name: 2-[2-(1,3-dioxan-2-yl)ethyl]-9-hydroxy-10-phenylsulfanyl-3,4-dihydro-2H-anthracen-1-one Traditional Name: 2-[2-(1,3-dioxan-2-yl)ethyl]-9-hydroxy-10-(phenylthio)-3,4-dihydro-2H-anthracen-1-one Formula: C26H26O4S MolecularWeight: 434.54724

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(OC1)CCC2CCC3=C(C4=CC=CC=C4C(=C3C2=O)O)SC5=CC=CC=C5

Isomeric SMILES

C1COC(OC1)CCC2CCC3=C(C4=CC=CC=C4C(=C3C2=O)O)SC5=CC=CC=C5

InChI

InChI=1S/C26H26O4S/c27-24-17(12-14-22-29-15-6-16-30-22)11-13-21-23(24)25(28)19-9-4-5-10-20(19)26(21)31-18-7-2-1-3-8-18/h1-5,7-10,17,22,28H,6,11-16H2