2-(4-chloranylphenoxy)-N-[1-(4-cyanobutyl)pyrazol-4-yl]-2-methyl-propanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[1-(4-cyanobutyl)pyrazol-4-yl]-2-methyl-propanamide Openeye Name: 2-(4-chlorophenoxy)-N-[1-(4-cyanobutyl)pyrazol-4-yl]-2-methyl-propanamide CAS Name: 2-(4-chlorophenoxy)-N-[1-(4-cyanobutyl)-4-pyrazolyl]-2-methylpropanamide IUPAC Name: 2-(4-chlorophenoxy)-N-[1-(4-cyanobutyl)pyrazol-4-yl]-2-methylpropanamide Traditional Name: 2-(4-chlorophenoxy)-N-[1-(4-cyanobutyl)pyrazol-4-yl]-2-methyl-propionamide Formula: C18H21ClN4O2 MolecularWeight: 360.83794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CN(N=C1)CCCCC#N)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C(=O)NC1=CN(N=C1)CCCCC#N)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H21ClN4O2/c1-18(2,25-16-8-6-14(19)7-9-16)17(24)22-15-12-21-23(13-15)11-5-3-4-10-20/h6-9,12-13H,3-5,11H2,1-2H3,(H,22,24)