N-(1,3-benzodioxol-5-ylmethyl)-5-[[3-methylbutyl-(phenylmethyl)amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[3-methylbutyl-(phenylmethyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[benzyl(isopentyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[3-methylbutyl-(phenylmethyl)amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[benzyl(3-methylbutyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[benzyl(isoamyl)amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC1=CC=CC=C1)CC2=CC(=NO2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)CCN(CC1=CC=CC=C1)CC2=CC(=NO2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H29N3O4/c1-18(2)10-11-28(15-19-6-4-3-5-7-19)16-21-13-22(27-32-21)25(29)26-14-20-8-9-23-24(12-20)31-17-30-23/h3-9,12-13,18H,10-11,14-17H2,1-2H3,(H,26,29)