2,8-bis(oxidanyl)-3-(phenylmethylsulfanyl)-5,6-dihydrobenzo[h]chromen-4-one

Systemtic Name: 2,8-bis(oxidanyl)-3-(phenylmethylsulfanyl)-5,6-dihydrobenzo[h]chromen-4-one Openeye Name: 3-benzylsulfanyl-2,8-dihydroxy-5,6-dihydrobenzo[h]chromen-4-one CAS Name: 2,8-dihydroxy-3-(phenylmethylthio)-5,6-dihydrobenzo[h][1]benzopyran-4-one IUPAC Name: 3-benzylsulfanyl-2,8-dihydroxy-5,6-dihydrobenzo[h]chromen-4-one Traditional Name: 3-(benzylthio)-2,8-dihydroxy-5,6-dihydrobenzo[h]chromen-4-one Formula: C20H16O4S MolecularWeight: 352.40364

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=C1C=C(C=C3)O)OC(=C(C2=O)SCC4=CC=CC=C4)O

Isomeric SMILES

C1CC2=C(C3=C1C=C(C=C3)O)OC(=C(C2=O)SCC4=CC=CC=C4)O

InChI

InChI=1S/C20H16O4S/c21-14-7-9-15-13(10-14)6-8-16-17(22)19(20(23)24-18(15)16)25-11-12-4-2-1-3-5-12/h1-5,7,9-10,21,23H,6,8,11H2