ZINC03098359
Molecular Formula:
C
15
H
24
NO
3
S
+
InChI:
InChI=1/C15H23NO3S/c17-13-4-5-14(18)15(12-13)20-11-3-1-2-6-16-7-9-19-10-8-16/h4-5,12,17-18H,1-3,6-11H2/p+1/fC15H24NO3S/h16H/q+1
InChIKey:
InChIKey=IGIHCUWPCQZQBN-OCZQRFOZCY
SMILES:
C1COCC[NH+]1CCCCCSC2=C(C=CC(=C2)O)O
Names:
ZINC03098359
2-[5-(1-oxa-4-azoniacyclohex-4-yl)pentylsulfanyl]benzene-1,4-diol
Registries:
PubChem CID 7034812
PubChem ID 12127456