NSC71133
Molecular Formula:
C
18
H
18
O
4
S
InChI:
InChI=1/C18H18O4S/c1-2-5-12-8-15-16(22-11-21-15)9-13(12)10-23-17-7-4-3-6-14(17)18(19)20/h3-4,6-9H,2,5,10-11H2,1H3,(H,19,20)/f/h19H
InChIKey:
InChIKey=CIIVNAYSHDJNNA-LILDFLRNCL
SMILES:
CCCC1=CC2=C(C=C1CSC3=CC=CC=C3C(=O)O)OCO2
Names:
NSC71133
2-[(6-propylbenzo[1,3]dioxol-5-yl)methylsulfanyl]benzoic acid
Registries:
PubChem CID 251047
PubChem ID 114244