5-chloranyl-N-hexyl-3-methyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-hexyl-3-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-hexyl-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-hexyl-3-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-hexyl-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-hexyl-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C17H22ClN3O MolecularWeight: 319.82908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=C(N(N=C1C)C2=CC=CC=C2)Cl

Isomeric SMILES

CCCCCCNC(=O)C1=C(N(N=C1C)C2=CC=CC=C2)Cl

InChI

InChI=1S/C17H22ClN3O/c1-3-4-5-9-12-19-17(22)15-13(2)20-21(16(15)18)14-10-7-6-8-11-14/h6-8,10-11H,3-5,9,12H2,1-2H3,(H,19,22)