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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-chloro-4-fluoro-phenyl)methyl]-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-chloro-4-fluorophenyl)methyl]-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-chloro-4-fluorophenyl)methyl]-1,5-dimethylpyrazole-3-carboxamide Traditional Name: N-(2-chloro-4-fluoro-benzyl)-1,5-dimethyl-N-piperonyl-pyrazole-3-carboxamide Formula: C21H19ClFN3O3 MolecularWeight: 415.845263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C21H19ClFN3O3/c1-13-7-18(24-25(13)2)21(27)26(11-15-4-5-16(23)9-17(15)22)10-14-3-6-19-20(8-14)29-12-28-19/h3-9H,10-12H2,1-2H3