N-butyl-3-(3-nitrophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: N-butyl-3-(3-nitrophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: N-butyl-3-(3-nitrophenyl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: N-butyl-3-(3-nitrophenyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: N-butyl-3-(3-nitrophenyl)-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: N-butyl-3-(3-nitrophenyl)-2-isoxazoline-5-carboxamide Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CC(=NO1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)C1CC(=NO1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O4/c1-2-3-7-15-14(18)13-9-12(16-21-13)10-5-4-6-11(8-10)17(19)20/h4-6,8,13H,2-3,7,9H2,1H3,(H,15,18)