N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl(cyclohexylcarbonyl)amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl(cyclohexylcarbonyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclohexanecarbonyl(sec-butyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-[cyclohexyl(oxo)methyl]amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl(cyclohexanecarbonyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[cyclohexanecarbonyl(sec-butyl)amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C24H31N3O5 MolecularWeight: 441.52004

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4CCCCC4

Isomeric SMILES

CCC(C)N(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4CCCCC4

InChI

InChI=1S/C24H31N3O5/c1-3-16(2)27(24(29)18-7-5-4-6-8-18)14-19-12-20(26-32-19)23(28)25-13-17-9-10-21-22(11-17)31-15-30-21/h9-12,16,18H,3-8,13-15H2,1-2H3,(H,25,28)