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

Systemtic Name: 5-butyl-3-(3-nitrophenyl)-4,5-dihydro-1,2-oxazole Openeye Name: 5-butyl-3-(3-nitrophenyl)-4,5-dihydroisoxazole CAS Name: 5-butyl-3-(3-nitrophenyl)-4,5-dihydroisoxazole IUPAC Name: 5-butyl-3-(3-nitrophenyl)-4,5-dihydro-1,2-oxazole Traditional Name: 5-butyl-3-(3-nitrophenyl)-2-isoxazoline Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(=NO1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCC1CC(=NO1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O3/c1-2-3-7-12-9-13(14-18-12)10-5-4-6-11(8-10)15(16)17/h4-6,8,12H,2-3,7,9H2,1H3