1,4-bis(fluoranyl)-5,8-bis(oxidanyl)-2-phenylazanyl-3-phenylsulfanyl-anthracene-9,10-dione

Systemtic Name: 1,4-bis(fluoranyl)-5,8-bis(oxidanyl)-2-phenylazanyl-3-phenylsulfanyl-anthracene-9,10-dione Openeye Name: 2-anilino-1,4-difluoro-5,8-dihydroxy-3-phenylsulfanyl-anthracene-9,10-dione CAS Name: 2-anilino-1,4-difluoro-5,8-dihydroxy-3-(phenylthio)anthracene-9,10-dione IUPAC Name: 2-anilino-1,4-difluoro-5,8-dihydroxy-3-phenylsulfanylanthracene-9,10-dione Traditional Name: 2-anilino-1,4-difluoro-5,8-dihydroxy-3-(phenylthio)-9,10-anthraquinone Formula: C26H15F2NO4S MolecularWeight: 475.463406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C3=C(C(=C2SC4=CC=CC=C4)F)C(=O)C5=C(C=CC(=C5C3=O)O)O)F

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C3=C(C(=C2SC4=CC=CC=C4)F)C(=O)C5=C(C=CC(=C5C3=O)O)O)F

InChI

InChI=1S/C26H15F2NO4S/c27-21-19-20(25(33)18-16(31)12-11-15(30)17(18)24(19)32)22(28)26(34-14-9-5-2-6-10-14)23(21)29-13-7-3-1-4-8-13/h1-12,29-31H