N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-phenylpyrazol-3-yl)methyl]-2,3-dihydro-1-benzofuran-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-phenylpyrazol-3-yl)methyl]-2,3-dihydro-1-benzofuran-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-phenylpyrazol-3-yl)methyl]-2,3-dihydrobenzofuran-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-phenyl-3-pyrazolyl)methyl]-2,3-dihydrobenzofuran-5-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(2-phenylpyrazol-3-yl)methyl]-2,3-dihydro-1-benzofuran-5-carboxamide Traditional Name: N-[(2-phenylpyrazol-3-yl)methyl]-N-piperonyl-coumaran-5-carboxamide Formula: C27H23N3O4 MolecularWeight: 453.48922

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C(=O)N(CC3=CC4=C(C=C3)OCO4)CC5=CC=NN5C6=CC=CC=C6

Isomeric SMILES

C1COC2=C1C=C(C=C2)C(=O)N(CC3=CC4=C(C=C3)OCO4)CC5=CC=NN5C6=CC=CC=C6

InChI

InChI=1S/C27H23N3O4/c31-27(21-7-9-24-20(15-21)11-13-32-24)29(16-19-6-8-25-26(14-19)34-18-33-25)17-23-10-12-28-30(23)22-4-2-1-3-5-22/h1-10,12,14-15H,11,13,16-18H2