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

Systemtic Name: 2-[1,4-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracen-2-yl]sulfanylethanoic acid Openeye Name: 2-[(1,4-dihydroxy-9,10-dioxo-2-anthryl)sulfanyl]acetic acid CAS Name: 2-[(1,4-dihydroxy-9,10-dioxo-2-anthracenyl)thio]acetic acid IUPAC Name: 2-(1,4-dihydroxy-9,10-dioxoanthracen-2-yl)sulfanylacetic acid Traditional Name: 2-[(1,4-dihydroxy-9,10-diketo-2-anthryl)thio]acetic acid Formula: C16H10O6S MolecularWeight: 330.312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)SCC(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)SCC(=O)O)O

InChI

InChI=1S/C16H10O6S/c17-9-5-10(23-6-11(18)19)16(22)13-12(9)14(20)7-3-1-2-4-8(7)15(13)21/h1-5,17,22H,6H2,(H,18,19)