5-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)iminomethyl]-7,9-dioxabicyclo[4.4.0]deca-2,4,11-triene-3-carboxylic acid
Molecular Formula:
C
21
H
19
N
3
O
5
InChI:
InChI=1/C21H19N3O5/c1-13-18(20(25)24(23(13)2)17-6-4-3-5-7-17)22-10-15-8-14(21(26)27)9-16-11-28-12-29-19(15)16/h3-10H,11-12H2,1-2H3,(H,26,27)/b22-10+/f/h26H
InChIKey:
InChIKey=QEBQJLWDNRMSGG-LILLWFBODZ
SMILES:
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C4C(=CC(=C3)C(=O)O)COCO4
Names:
5-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)iminomethyl]-7,9-dioxabicyclo[4.4.0]deca-2,4,11-triene-3-carboxylic acid
Registries:
PubChem CID 1253206
PubChem ID 4840552