2-[1,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]sulfanylethyl benzoate

Systemtic Name: 2-[1,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]sulfanylethyl benzoate Openeye Name: 2-[(1,4-dihydroxy-9,10-dioxo-2-anthryl)sulfanyl]ethyl benzoate CAS Name: benzoic acid 2-[(1,4-dihydroxy-9,10-dioxo-2-anthracenyl)thio]ethyl ester IUPAC Name: 2-(1,4-dihydroxy-9,10-dioxoanthracen-2-yl)sulfanylethyl benzoate Traditional Name: benzoic acid 2-[(1,4-dihydroxy-9,10-diketo-2-anthryl)thio]ethyl ester Formula: C23H16O6S MolecularWeight: 420.43454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCSC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCSC2=C(C3=C(C(=C2)O)C(=O)C4=CC=CC=C4C3=O)O

InChI

InChI=1S/C23H16O6S/c24-16-12-17(30-11-10-29-23(28)13-6-2-1-3-7-13)22(27)19-18(16)20(25)14-8-4-5-9-15(14)21(19)26/h1-9,12,24,27H,10-11H2