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

Systemtic Name: 2-[3-(carboxymethylsulfanyl)-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylethanoic acid Openeye Name: 2-[[3-(carboxymethylsulfanyl)-1,4-dioxo-2-naphthyl]sulfanyl]acetic acid CAS Name: 2-[[3-(carboxymethylthio)-1,4-dioxo-2-naphthalenyl]thio]acetic acid IUPAC Name: 2-[3-(carboxymethylsulfanyl)-1,4-dioxonaphthalen-2-yl]sulfanylacetic acid Traditional Name: 2-[[3-(carboxymethylthio)-1,4-diketo-2-naphthyl]thio]acetic acid Formula: C14H10O6S2 MolecularWeight: 338.3556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10O6S2/c15-9(16)5-21-13-11(19)7-3-1-2-4-8(7)12(20)14(13)22-6-10(17)18/h1-4H,5-6H2,(H,15,16)(H,17,18)