6,11-bis(oxidanyl)-2,3,8,9-tetrakis(phenylsulfanyl)tetracene-5,12-dione

Systemtic Name: 6,11-bis(oxidanyl)-2,3,8,9-tetrakis(phenylsulfanyl)tetracene-5,12-dione Openeye Name: 6,11-dihydroxy-2,3,8,9-tetrakis(phenylsulfanyl)tetracene-5,12-dione CAS Name: 6,11-dihydroxy-2,3,8,9-tetrakis(phenylthio)tetracene-5,12-dione IUPAC Name: 6,11-dihydroxy-2,3,8,9-tetrakis(phenylsulfanyl)tetracene-5,12-dione Traditional Name: 6,11-dihydroxy-2,3,8,9-tetrakis(phenylthio)tetracene-5,12-quinone Formula: C42H26O4S4 MolecularWeight: 722.91344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(C=C3C(=C2)C(=C4C(=C3O)C(=O)C5=CC(=C(C=C5C4=O)SC6=CC=CC=C6)SC7=CC=CC=C7)O)SC8=CC=CC=C8

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(C=C3C(=C2)C(=C4C(=C3O)C(=O)C5=CC(=C(C=C5C4=O)SC6=CC=CC=C6)SC7=CC=CC=C7)O)SC8=CC=CC=C8

InChI

InChI=1S/C42H26O4S4/c43-39-29-21-33(47-25-13-5-1-6-14-25)34(48-26-15-7-2-8-16-26)22-30(29)40(44)38-37(39)41(45)31-23-35(49-27-17-9-3-10-18-27)36(24-32(31)42(38)46)50-28-19-11-4-12-20-28/h1-24,43-44H