N-(2-methylpropyl)-5-[[2-methylpropyl-(3-nitrophenyl)carbonyl-amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(2-methylpropyl)-5-[[2-methylpropyl-(3-nitrophenyl)carbonyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-isobutyl-5-[[isobutyl-(3-nitrobenzoyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(2-methylpropyl)-5-[[2-methylpropyl-[(3-nitrophenyl)-oxomethyl]amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(2-methylpropyl)-5-[[2-methylpropyl-(3-nitrobenzoyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-isobutyl-5-[[isobutyl-(3-nitrobenzoyl)amino]methyl]isoxazole-3-carboxamide Formula: C20H26N4O5 MolecularWeight: 402.44424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=NOC(=C1)CN(CC(C)C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)C1=NOC(=C1)CN(CC(C)C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O5/c1-13(2)10-21-19(25)18-9-17(29-22-18)12-23(11-14(3)4)20(26)15-6-5-7-16(8-15)24(27)28/h5-9,13-14H,10-12H2,1-4H3,(H,21,25)