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6-butylsulfanylnaphthalene-2-carboxylic acid

6-butylsulfanylnaphthalene-2-carboxylic acid

Systemtic Name:6-butylsulfanylnaphthalene-2-carboxylic acid
Openeye Name:6-butylsulfanylnaphthalene-2-carboxylic acid
CAS Name:6-(butylthio)-2-naphthalenecarboxylic acid
IUPAC Name:6-butylsulfanylnaphthalene-2-carboxylic acid
Traditional Name:6-(butylthio)-2-naphthoic acid
Formula: C15H16O2S
MolecularWeight: 260.35134
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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC2=C(C=C1)C=C(C=C2)C(=O)O


Isomeric SMILES

CCCCSC1=CC2=C(C=C1)C=C(C=C2)C(=O)O


InChI

InChI=1S/C15H16O2S/c1-2-3-8-18-14-7-6-11-9-13(15(16)17)5-4-12(11)10-14/h4-7,9-10H,2-3,8H2,1H3,(H,16,17)


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