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NK372135C

PropertiesImage
MNX_IDMNXM107283 Image of MNXM107283
referencechebi:66633
formulaC20H18N2O3
global charge0
mol weight334.375
InChIKeyOSJAZSFVURTOLX-LICLKQGHSA-N
InChIInChI=1S/C20H18N2O3/c1-24-18-6-3-14(4-7-18)9-16(12-21)17(13-22)10-15-5-8-20(25-2)19(23)11-15/h3-8,10-11,16,23H,9H2,1-2H3/b17-10+
SMILESCOC1=CC=C(CC(C#N)/C(C#N)=C/C2=CC=C(OC)C(O)=C2)C=C1
MNX internals
InChI (mnx)InChI=1/C20H18N2O3/c1-24-18-6-3-14(4-7-18)9-16(12-21)17(13-22)10-15-5-8-20(25-2)19(23)11-15/h3-8,10-11,16,23H,9H2,1-2H3/b17-10+/t16? Image of MNXM107283
SMILES (mnx)[CH3:1][O:24][C:18]1=[CH:7][CH:4]=[C:14]([CH2:9][CH:16]([C:12]#[N:21])/[C:17](=[CH:10]/[C:15]2=[CH:11][C:19]([OH:23])=[C:20]([O:25][CH3:2])[CH:8]=[CH:5]2)[C:13]#[N:22])[CH:3]=[CH:6]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:66633
chebi:66633
OSJAZSFVURTOLX-LICLKQGHSA-N 		NK372135C
(2Z)-2-(3-hydroxy-4-methoxybenzylidene)-3-(4-methoxybenzyl)butanedinitrile