4-methoxy-N,N'-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide hydrate
Molecular Formula:
C
21
H
22
N
4
O
4
InChI:
InChI=1/C21H20N4O3.H2O/c1-28-19-7-6-17(20(26)24-13-15-4-2-8-22-11-15)10-18(19)21(27)25-14-16-5-3-9-23-12-16;/h2-12H,13-14H2,1H3,(H,24,26)(H,25,27);1H2/f/h24-25H;
InChIKey:
InChIKey=ICYQAMNVLLHURR-KHJCMUKDCN
SMILES:
COC1=C(C=C(C=C1)C(=O)NCC2=CN=CC=C2)C(=O)NCC3=CN=CC=C3.O
Names:
4-methoxy-N,N'-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide hydrate
Registries:
PubChem CID 6419975
PubChem ID 11618469
