2-[1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylethanoic acid Openeye Name: 2-[(1,4-dioxo-2-naphthyl)sulfanyl]acetic acid CAS Name: 2-[(1,4-dioxo-2-naphthalenyl)thio]acetic acid IUPAC Name: 2-(1,4-dioxonaphthalen-2-yl)sulfanylacetic acid Traditional Name: 2-[(1,4-diketo-2-naphthyl)thio]acetic acid Formula: C12H8O4S MolecularWeight: 248.25452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8O4S/c13-9-5-10(17-6-11(14)15)12(16)8-4-2-1-3-7(8)9/h1-5H,6H2,(H,14,15)