N-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorophenyl)-5-(furan-2-yl)pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorophenyl)-5-(furan-2-yl)pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorophenyl)-5-(2-furyl)pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorophenyl)-5-(2-furanyl)-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-chlorophenyl)-5-(furan-2-yl)pyrazole-3-carboxamide Traditional Name: 2-(3-chlorophenyl)-5-(2-furyl)-N-piperonyl-pyrazole-3-carboxamide Formula: C22H16ClN3O4 MolecularWeight: 421.83314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=NN3C4=CC(=CC=C4)Cl)C5=CC=CO5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=NN3C4=CC(=CC=C4)Cl)C5=CC=CO5

InChI

InChI=1S/C22H16ClN3O4/c23-15-3-1-4-16(10-15)26-18(11-17(25-26)19-5-2-8-28-19)22(27)24-12-14-6-7-20-21(9-14)30-13-29-20/h1-11H,12-13H2,(H,24,27)