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

Systemtic Name: N-(2-methylpropyl)-5-[[(3-nitrophenyl)carbonyl-(oxolan-2-ylmethyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-isobutyl-5-[[(3-nitrobenzoyl)-(tetrahydrofuran-2-ylmethyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(2-methylpropyl)-5-[[[(3-nitrophenyl)-oxomethyl]-(2-oxolanylmethyl)amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(2-methylpropyl)-5-[[(3-nitrobenzoyl)-(oxolan-2-ylmethyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-isobutyl-5-[[(3-nitrobenzoyl)-(tetrahydrofurfuryl)amino]methyl]isoxazole-3-carboxamide Formula: C21H26N4O6 MolecularWeight: 430.45434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=NOC(=C1)CN(CC2CCCO2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)C1=NOC(=C1)CN(CC2CCCO2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O6/c1-14(2)11-22-20(26)19-10-18(31-23-19)13-24(12-17-7-4-8-30-17)21(27)15-5-3-6-16(9-15)25(28)29/h3,5-6,9-10,14,17H,4,7-8,11-13H2,1-2H3,(H,22,26)