N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazole-4-carboxamide Traditional Name: 1-(2-chlorobenzyl)-3,5-dimethyl-N-piperonyl-pyrazole-4-carboxamide Formula: C21H20ClN3O3 MolecularWeight: 397.8548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H20ClN3O3/c1-13-20(14(2)25(24-13)11-16-5-3-4-6-17(16)22)21(26)23-10-15-7-8-18-19(9-15)28-12-27-18/h3-9H,10-12H2,1-2H3,(H,23,26)