Quinaldine blue (USAN/INN)

Properties Image MNX_ID MNXM160734 reference keggD:D05672 formula C25H25ClN2 global charge 0 mol weight 388.942 InChIKey FVMNARAKYNRZID-UHFFFAOYSA-M InChI InChI=1S/C25H25N2.ClH/c1-3-26-22(18-16-20-10-5-7-14-24(20)26)12-9-13-23-19-17-21-11-6-8-15-25(21)27(23)4-2;/h5-19H,3-4H2,1-2H3;1H/q+1;/p-1 SMILES CCN1C2=CC=CC=C2C=C/C1=C\C=C\C1=CC=C2C=CC=CC2=[N+]1CC.[Cl-] MNX internals InChI (mnx) InChI=1/C25H25N2.ClH/c1-3-26-22(18-16-20-10-5-7-14-24(20)26)12-9-13-23-19-17-21-11-6-8-15-25(21)27(23)4-2;/h5-19H,3-4H2,1-2H3;1H/q+1; SMILES (mnx) [CH3:1][CH2:3][N+:26]1=[C:22]([CH:12]=[CH:9][CH:13]=[C:23]2[CH:19]=[CH:17][C:21]3=[CH:11][CH:6]=[CH:8][CH:15]=[C:25]3[N:27]2[CH2:4][CH3:2])[CH:18]=[CH:16][C:20]2=[CH:10][CH:5]=[CH:7][CH:14]=[C:24]21.[ClH:28]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0