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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-(3-nitrophenyl)carbonyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(3-nitrobenzoyl)-sec-butyl-amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-[(3-nitrophenyl)-oxomethyl]amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-(3-nitrobenzoyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[(3-nitrobenzoyl)-sec-butyl-amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C24H24N4O7 MolecularWeight: 480.46996

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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)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC(C)N(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H24N4O7/c1-3-15(2)27(24(30)17-5-4-6-18(10-17)28(31)32)13-19-11-20(26-35-19)23(29)25-12-16-7-8-21-22(9-16)34-14-33-21/h4-11,15H,3,12-14H2,1-2H3,(H,25,29)