2-[5,8-bis(oxidanyl)-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylpropanoic acid

Systemtic Name: 2-[5,8-bis(oxidanyl)-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylpropanoic acid Openeye Name: 2-[(5,8-dihydroxy-1,4-dioxo-2-naphthyl)sulfanyl]propanoic acid CAS Name: 2-[(5,8-dihydroxy-1,4-dioxo-2-naphthalenyl)thio]propanoic acid IUPAC Name: 2-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)sulfanylpropanoic acid Traditional Name: 2-[(5,8-dihydroxy-1,4-diketo-2-naphthyl)thio]propionic acid Formula: C13H10O6S MolecularWeight: 294.2799

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=CC(=O)C2=C(C=CC(=C2C1=O)O)O

Isomeric SMILES

CC(C(=O)O)SC1=CC(=O)C2=C(C=CC(=C2C1=O)O)O

InChI

InChI=1S/C13H10O6S/c1-5(13(18)19)20-9-4-8(16)10-6(14)2-3-7(15)11(10)12(9)17/h2-5,14-15H,1H3,(H,18,19)