N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-phenylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-phenylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-phenylphenoxy)methyl]-N-piperonyl-pyrazole-3-carboxamide Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=NN(C=C3)COC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H21N3O4/c29-25(26-15-18-6-11-23-24(14-18)32-17-31-23)22-12-13-28(27-22)16-30-21-9-7-20(8-10-21)19-4-2-1-3-5-19/h1-14H,15-17H2,(H,26,29)