DIFENOXIN ,28782-42-5 _Chemical Cloud Database

DIFENOXIN

Basic Information
Product Name：	DIFENOXIN
CAS：	28782-42-5
English Synonyms：	DIFENOXINE ; DIFENOXYLIC ACID ; 1-(3-CYANO-3,3-DIPHENYLPROPYL)-4-PHENYLISONIPECOTIC ACID ; LYSPAFEN ; MCN-JR 15403-11 ; DIFENOXILIC ACID ; DIFENOXIN ; DIPHENOXYLIC ACID ; 1-(3-CYANO-3,3-DIPHENYLPROPYL)-4-PHENYL-4-PIPERIDINECARBOXYLIC ACID
MDL Number.：	MFCD00866590
H bond acceptor：	4
H bond donor：	1
Smile：	c1ccc(cc1)C2(CCN(CC2)CCC(C#N)(c3ccccc3)c4ccccc4)C(=O)O
InChi：	InChI=1S/C28H28N2O2/c29-22-28(24-12-6-2-7-13-24,25-14-8-3-9-15-25)18-21-30-19-16-27(17-20-30,26(31)32)23-10-4-1-5-11-23/h1-15H,16-21H2,(H,31,32)
InChiKey：	InChIKey=UFIVBRCCIRTJTN-UHFFFAOYSA-N

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