N'-[4-(4-chloranyl-2-methyl-phenoxy)butanoyl]-2-oxidanylidene-1H-quinoline-3-carbohydrazide

Systemtic Name: N'-[4-(4-chloranyl-2-methyl-phenoxy)butanoyl]-2-oxidanylidene-1H-quinoline-3-carbohydrazide Openeye Name: N'-[4-(4-chloro-2-methyl-phenoxy)butanoyl]-2-oxo-1H-quinoline-3-carbohydrazide CAS Name: N'-[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]-2-oxo-1H-quinoline-3-carbohydrazide IUPAC Name: N'-[4-(4-chloro-2-methylphenoxy)butanoyl]-2-oxo-1H-quinoline-3-carbohydrazide Traditional Name: N'-[4-(4-chloro-2-methyl-phenoxy)butanoyl]-2-keto-1H-quinoline-3-carbohydrazide Formula: C21H20ClN3O4 MolecularWeight: 413.8542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NNC(=O)C2=CC3=CC=CC=C3NC2=O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NNC(=O)C2=CC3=CC=CC=C3NC2=O

InChI

InChI=1S/C21H20ClN3O4/c1-13-11-15(22)8-9-18(13)29-10-4-7-19(26)24-25-21(28)16-12-14-5-2-3-6-17(14)23-20(16)27/h2-3,5-6,8-9,11-12H,4,7,10H2,1H3,(H,23,27)(H,24,26)(H,25,28)