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

Systemtic Name: [2-[2-(1,3-dioxan-2-yl)ethyl]-1-oxidanylidene-10-phenylsulfanyl-3,4-dihydro-2H-anthracen-9-yl] ethanoate Openeye Name: [2-[2-(1,3-dioxan-2-yl)ethyl]-1-oxo-10-phenylsulfanyl-3,4-dihydro-2H-anthracen-9-yl] acetate CAS Name: acetic acid [2-[2-(1,3-dioxan-2-yl)ethyl]-1-oxo-10-(phenylthio)-3,4-dihydro-2H-anthracen-9-yl] ester IUPAC Name: [2-[2-(1,3-dioxan-2-yl)ethyl]-1-oxo-10-phenylsulfanyl-3,4-dihydro-2H-anthracen-9-yl] acetate Traditional Name: acetic acid [2-[2-(1,3-dioxan-2-yl)ethyl]-1-keto-10-(phenylthio)-3,4-dihydro-2H-anthracen-9-yl] ester Formula: C28H28O5S MolecularWeight: 476.58392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C2C(=C(C3=CC=CC=C31)SC4=CC=CC=C4)CCC(C2=O)CCC5OCCCO5

Isomeric SMILES

CC(=O)OC1=C2C(=C(C3=CC=CC=C31)SC4=CC=CC=C4)CCC(C2=O)CCC5OCCCO5

InChI

InChI=1S/C28H28O5S/c1-18(29)33-27-21-10-5-6-11-22(21)28(34-20-8-3-2-4-9-20)23-14-12-19(26(30)25(23)27)13-15-24-31-16-7-17-32-24/h2-6,8-11,19,24H,7,12-17H2,1H3