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

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

Systemtic Name:2-[3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]sulfanylpropanoic acid
Openeye Name:2-[(3-methyl-1,4-dioxo-2-naphthyl)sulfanyl]propanoic acid
CAS Name:2-[(3-methyl-1,4-dioxo-2-naphthalenyl)thio]propanoic acid
IUPAC Name:2-(3-methyl-1,4-dioxonaphthalen-2-yl)sulfanylpropanoic acid
Traditional Name:2-[(1,4-diketo-3-methyl-2-naphthyl)thio]propionic acid
Formula: C14H12O4S
MolecularWeight: 276.30768
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C14H12O4S/c1-7-11(15)9-5-3-4-6-10(9)12(16)13(7)19-8(2)14(17)18/h3-6,8H,1-2H3,(H,17,18)


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