Search MNXref
 Feedback

3-(1H-indol-3-yl)propanoate cation radical

PropertiesImage
MNX_IDMNXM1100449 Image of MNXM1100449
referencemetacycM:CPD-21500
formulaC11H9NO2
global charge-1
mol weight187.198
InChIKeyAZDKJLXWZXJHQV-UHFFFAOYSA-M
InChIInChI=1S/C11H10NO2/c13-11(14)6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7H,5-6H2,(H,13,14)/p-1
SMILESO=C([O-])CCC1=C[N]C2=C1C=CC=C2
MNX internals
InChI (mnx)InChI=1/C11H10NO2/c13-11(14)6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7H,5-6H2,(H,13,14) Image of MNXM1100449
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:10]2[C:9](=[CH:3]1)[C:8]([CH2:5][CH2:6][C:11](=[O:13])[OH:14])=[CH:7][N:12]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-21500
metacycM:CPD-21500
seed.compound:cpd31892
seedM:cpd31892
AZDKJLXWZXJHQV-UHFFFAOYSA-M
3-(1H-indol-3-yl)propanoate cation radical

seedM:M_cpd31892
secondary/obsolete/fantasy identifier