N-butan-2-yl-2-[[butan-2-yl-(3-nitrophenyl)carbonyl-amino]methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: N-butan-2-yl-2-[[butan-2-yl-(3-nitrophenyl)carbonyl-amino]methyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-[[(3-nitrobenzoyl)-sec-butyl-amino]methyl]-N-sec-butyl-oxazole-4-carboxamide CAS Name: N-butan-2-yl-2-[[butan-2-yl-[(3-nitrophenyl)-oxomethyl]amino]methyl]-4-oxazolecarboxamide IUPAC Name: N-butan-2-yl-2-[[butan-2-yl-(3-nitrobenzoyl)amino]methyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[[(3-nitrobenzoyl)-sec-butyl-amino]methyl]-N-sec-butyl-oxazole-4-carboxamide Formula: C20H26N4O5 MolecularWeight: 402.44424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=COC(=N1)CN(C(C)CC)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC(=O)C1=COC(=N1)CN(C(C)CC)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O5/c1-5-13(3)21-19(25)17-12-29-18(22-17)11-23(14(4)6-2)20(26)15-8-7-9-16(10-15)24(27)28/h7-10,12-14H,5-6,11H2,1-4H3,(H,21,25)