methyl 2-[6,7-bis(oxidanyl)naphthalen-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[6,7-bis(oxidanyl)naphthalen-2-yl]sulfanylethanoate Openeye Name: methyl 2-[(6,7-dihydroxy-2-naphthyl)sulfanyl]acetate CAS Name: 2-[(6,7-dihydroxy-2-naphthalenyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(6,7-dihydroxynaphthalen-2-yl)sulfanylacetate Traditional Name: 2-[(6,7-dihydroxy-2-naphthyl)thio]acetic acid methyl ester Formula: C13H12O4S MolecularWeight: 264.29698

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=CC2=CC(=C(C=C2C=C1)O)O

Isomeric SMILES

COC(=O)CSC1=CC2=CC(=C(C=C2C=C1)O)O

InChI

InChI=1S/C13H12O4S/c1-17-13(16)7-18-10-3-2-8-5-11(14)12(15)6-9(8)4-10/h2-6,14-15H,7H2,1H3