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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(3,4-dimethylphenyl)-2-phenyl-pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(3,4-dimethylphenyl)-2-phenyl-pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(3,4-dimethylphenyl)-2-phenyl-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(3,4-dimethylphenyl)-2-phenylpyrazole-3-carboxamide Traditional Name: 5-(3,4-dimethylphenyl)-2-phenyl-N-piperonyl-pyrazole-3-carboxamide Formula: C26H23N3O3 MolecularWeight: 425.47912

Click to see the large picture

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=C5)C

Isomeric SMILES

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

InChI

InChI=1S/C26H23N3O3/c1-17-8-10-20(12-18(17)2)22-14-23(29(28-22)21-6-4-3-5-7-21)26(30)27-15-19-9-11-24-25(13-19)32-16-31-24/h3-14H,15-16H2,1-2H3,(H,27,30)