2-[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylethanoic acid Openeye Name: 2-[(3-chloro-1,4-dioxo-2-naphthyl)sulfanyl]acetic acid CAS Name: 2-[(3-chloro-1,4-dioxo-2-naphthalenyl)thio]acetic acid IUPAC Name: 2-(3-chloro-1,4-dioxonaphthalen-2-yl)sulfanylacetic acid Traditional Name: 2-[(3-chloro-1,4-diketo-2-naphthyl)thio]acetic acid Formula: C12H7ClO4S MolecularWeight: 282.69958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H7ClO4S/c13-9-10(16)6-3-1-2-4-7(6)11(17)12(9)18-5-8(14)15/h1-4H,5H2,(H,14,15)