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2-[(2-oxidanyl-5-oxidanylidene-7,8-dihydro-6H-naphthalen-1-yl)methylsulfanyl]ethanoic acid

2-[(2-oxidanyl-5-oxidanylidene-7,8-dihydro-6H-naphthalen-1-yl)methylsulfanyl]ethanoic acid

Systemtic Name:2-[(2-oxidanyl-5-oxidanylidene-7,8-dihydro-6H-naphthalen-1-yl)methylsulfanyl]ethanoic acid
Openeye Name:2-[(6-hydroxy-1-oxo-tetralin-5-yl)methylsulfanyl]acetic acid
CAS Name:2-[(2-hydroxy-5-oxo-7,8-dihydro-6H-naphthalen-1-yl)methylthio]acetic acid
IUPAC Name:2-[(2-hydroxy-5-oxo-7,8-dihydro-6H-naphthalen-1-yl)methylsulfanyl]acetic acid
Traditional Name:2-[(6-hydroxy-1-keto-tetralin-5-yl)methylthio]acetic acid
Formula: C13H14O4S
MolecularWeight: 266.31286
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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2CSCC(=O)O)O)C(=O)C1


Isomeric SMILES

C1CC2=C(C=CC(=C2CSCC(=O)O)O)C(=O)C1


InChI

InChI=1S/C13H14O4S/c14-11-3-1-2-8-9(11)4-5-12(15)10(8)6-18-7-13(16)17/h4-5,15H,1-3,6-7H2,(H,16,17)


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