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

Systemtic Name: 2-[3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylethanoic acid Openeye Name: 2-[(3-methyl-1,4-dioxo-2-naphthyl)sulfanyl]acetic acid CAS Name: 2-[(3-methyl-1,4-dioxo-2-naphthalenyl)thio]acetic acid IUPAC Name: 2-(3-methyl-1,4-dioxonaphthalen-2-yl)sulfanylacetic acid Traditional Name: 2-[(1,4-diketo-3-methyl-2-naphthyl)thio]acetic acid Formula: C13H10O4S MolecularWeight: 262.2811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC=CC=C2C1=O)SCC(=O)O

Isomeric SMILES

CC1=C(C(=O)C2=CC=CC=C2C1=O)SCC(=O)O

InChI

InChI=1S/C13H10O4S/c1-7-11(16)8-4-2-3-5-9(8)12(17)13(7)18-6-10(14)15/h2-5H,6H2,1H3,(H,14,15)