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(2S)-3-(1H-indol-3-yl)-2-isocyanopropanoate

PropertiesImage
MNX_IDMNXM1100438 Image of MNXM1100438
referenceseedM:cpd31820
formulaC12H10N2O2
global charge0
mol weight214.224
InChIKeyZDKNRNNOAIRCLA-NSHDSACASA-N
InChIInChI=1S/C12H10N2O2/c1-13-11(12(15)16)6-8-7-14-10-5-3-2-4-9(8)10/h1-5,7,11,14H,6H2/t11-/m0/s1
SMILESC#[N+][C@@H](CC1=CNC2=CC=CC=C12)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C12H10N2O2/c1-13-11(12(15)16)6-8-7-14-10-5-3-2-4-9(8)10/h1-5,7,11,14H,6H2/t11-/m0/s1 Image of MNXM1100438
SMILES (mnx)[CH:1]#[N+:13][C@@H:11]([CH2:6][C:8]1=[CH:7][NH:14][C:10]2=[CH:5][CH:3]=[CH:2][CH:4]=[C:9]12)[C:12](=[O:15])[O-:16]
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

seed.compound:cpd31820
seedM:cpd31820
ZDKNRNNOAIRCLA-NSHDSACASA-N
(2S)-3-(1H-indol-3-yl)-2-isocyanopropanoate
L-tryptophan isonitrile

seedM:M_cpd31820
secondary/obsolete/fantasy identifier