N'-(1,3-benzodioxol-5-ylcarbonyl)-3-(4-chlorophenyl)-1-(phenylmethyl)pyrazole-4-carbohydrazide

Systemtic Name: N'-(1,3-benzodioxol-5-ylcarbonyl)-3-(4-chlorophenyl)-1-(phenylmethyl)pyrazole-4-carbohydrazide Openeye Name: N'-(1,3-benzodioxole-5-carbonyl)-1-benzyl-3-(4-chlorophenyl)pyrazole-4-carbohydrazide CAS Name: N'-[1,3-benzodioxol-5-yl(oxo)methyl]-3-(4-chlorophenyl)-1-(phenylmethyl)-4-pyrazolecarbohydrazide IUPAC Name: N'-(1,3-benzodioxole-5-carbonyl)-1-benzyl-3-(4-chlorophenyl)pyrazole-4-carbohydrazide Traditional Name: 1-benzyl-3-(4-chlorophenyl)-N'-piperonyloyl-pyrazole-4-carbohydrazide Formula: C25H19ClN4O4 MolecularWeight: 474.89576

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NNC(=O)C3=CN(N=C3C4=CC=C(C=C4)Cl)CC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NNC(=O)C3=CN(N=C3C4=CC=C(C=C4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C25H19ClN4O4/c26-19-9-6-17(7-10-19)23-20(14-30(29-23)13-16-4-2-1-3-5-16)25(32)28-27-24(31)18-8-11-21-22(12-18)34-15-33-21/h1-12,14H,13,15H2,(H,27,31)(H,28,32)