(5E)-N-(4-chloranyl-2-methyl-phenyl)-5-(2-cyanoethanoylhydrazinylidene)-6-(phenylcarbonyl)octanamide

Systemtic Name: (5E)-N-(4-chloranyl-2-methyl-phenyl)-5-(2-cyanoethanoylhydrazinylidene)-6-(phenylcarbonyl)octanamide Openeye Name: (5E)-6-benzoyl-N-(4-chloro-2-methyl-phenyl)-5-[(2-cyanoacetyl)hydrazono]octanamide CAS Name: (5E)-6-benzoyl-N-(4-chloro-2-methylphenyl)-5-[(2-cyano-1-oxoethyl)hydrazinylidene]octanamide IUPAC Name: (5E)-6-benzoyl-N-(4-chloro-2-methylphenyl)-5-[(2-cyanoacetyl)hydrazinylidene]octanamide Traditional Name: (5E)-6-benzoyl-N-(4-chloro-2-methyl-phenyl)-5-[(2-cyanoacetyl)hydrazono]caprylamide Formula: C25H27ClN4O3 MolecularWeight: 466.95988

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=NNC(=O)CC#N)CCCC(=O)NC1=C(C=C(C=C1)Cl)C)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(/C(=N/NC(=O)CC#N)/CCCC(=O)NC1=C(C=C(C=C1)Cl)C)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C25H27ClN4O3/c1-3-20(25(33)18-8-5-4-6-9-18)22(29-30-24(32)14-15-27)10-7-11-23(31)28-21-13-12-19(26)16-17(21)2/h4-6,8-9,12-13,16,20H,3,7,10-11,14H2,1-2H3,(H,28,31)(H,30,32)/b29-22+