(2Z)-3-[1-(3-AMINO-3-OXOPROPYL)-3-(3,4-DIMETHOXYPHENYL)-1H-PYRAZOL-4-YL]-2-CYANOACRYLIC ACID

CAS No.
926189-97-1
CCD No.
CCD00538836
Formula
C18 H18 N4 O5
MolWeight
370.363

Basic Information

Product Name: (2Z)-3-[1-(3-AMINO-3-OXOPROPYL)-3-(3,4-DIMETHOXYPHENYL)-1H-PYRAZOL-4-YL]-2-CYANOACRYLIC ACID
CAS: 926189-97-1
English Synonyms: (2Z)-3-[1-(3-AMINO-3-OXOPROPYL)-3-(3,4-DIMETHOXYPHENYL)-1H-PYRAZOL-4-YL]-2-CYANOACRYLIC ACID
MDL Number.: MFCD06358005
H bond acceptor: 9
H bond donor: 2
Smile: COc1ccc(cc1OC)c2c(cn(n2)CCC(=O)N)/C=C(/C#N)\C(=O)O
InChi: InChI=1S/C18H18N4O5/c1-26-14-4-3-11(8-15(14)27-2)17-13(7-12(9-19)18(24)25)10-22(21-17)6-5-16(20)23/h3-4,7-8,10H,5-6H2,1-2H3,(H2,20,23)(H,24,25)/b12-7-
InChiKey: InChIKey=JWTSCHAZXOZFLS-GHXNOFRVSA-N

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