N-(1,3-benzodioxol-5-ylmethyl)-2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)pyrazole-3-carboxamide Traditional Name: 2-(2-chlorophenyl)-5-(3,4-dimethylphenyl)-N-piperonyl-pyrazole-3-carboxamide Formula: C26H22ClN3O3 MolecularWeight: 459.92418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5Cl)C

InChI

InChI=1S/C26H22ClN3O3/c1-16-7-9-19(11-17(16)2)21-13-23(30(29-21)22-6-4-3-5-20(22)27)26(31)28-14-18-8-10-24-25(12-18)33-15-32-24/h3-13H,14-15H2,1-2H3,(H,28,31)