N-[3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]pyrazol-4-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]pyrazol-4-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]pyrazol-4-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-4-pyrazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]pyrazol-4-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3,5-dimethyl-1-(3-phenoxybenzyl)pyrazol-4-yl]-piperonylamide Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)OC3=CC=CC=C3)C)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)OC3=CC=CC=C3)C)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H23N3O4/c1-17-25(27-26(30)20-11-12-23-24(14-20)32-16-31-23)18(2)29(28-17)15-19-7-6-10-22(13-19)33-21-8-4-3-5-9-21/h3-14H,15-16H2,1-2H3,(H,27,30)