2-chloro-5-[(4E)-4-[[3-methoxy-4-(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)oxy-phenyl]methylidene]-3-methyl-5-oxo-pyrazol-1-yl]benzoic acid
Molecular Formula:
C
27
H
23
ClN
6
O
7
InChI:
InChI=1/C27H23ClN6O7/c1-13-16(23(35)34(30-13)15-7-8-18(28)17(12-15)25(37)38)10-14-6-9-19(20(11-14)40-5)41-26-29-22-21(31(26)2)24(36)33(4)27(39)32(22)3/h6-12H,1-5H3,(H,37,38)/b16-10+/f/h37H
InChIKey:
InChIKey=KTJTUESLMDUDHM-PXVNENSIDM
SMILES:
CC1=NN(C(=O)C1=CC2=CC(=C(C=C2)OC3=NC4=C(N3C)C(=O)N(C(=O)N4C)C)OC)C5=CC(=C(C=C5)Cl)C(=O)O
Names:
2-chloro-5-[(4E)-4-[[3-methoxy-4-(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)oxy-phenyl]methylidene]-3-methyl-5-oxo-pyrazol-1-yl]benzoic acid
Registries:
PubChem CID 5343266
PubChem ID 11575262