3-(1,3-benzodioxol-5-ylmethyl)-N-[(3-phenyl-1H-pyrazol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-[(3-phenyl-1H-pyrazol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-[(3-phenyl-1H-pyrazol-5-yl)methyl]-4,5-dihydroisoxazole-5-carboxamide CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-[(3-phenyl-1H-pyrazol-5-yl)methyl]-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-[(3-phenyl-1H-pyrazol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: N-[(3-phenyl-1H-pyrazol-5-yl)methyl]-3-piperonyl-2-isoxazoline-5-carboxamide Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1CC2=CC3=C(C=C2)OCO3)C(=O)NCC4=CC(=NN4)C5=CC=CC=C5

Isomeric SMILES

C1C(ON=C1CC2=CC3=C(C=C2)OCO3)C(=O)NCC4=CC(=NN4)C5=CC=CC=C5

InChI

InChI=1S/C22H20N4O4/c27-22(23-12-17-10-18(25-24-17)15-4-2-1-3-5-15)21-11-16(26-30-21)8-14-6-7-19-20(9-14)29-13-28-19/h1-7,9-10,21H,8,11-13H2,(H,23,27)(H,24,25)