5-butyl-2-(3-nitrophenyl)-6-oxidanyl-1,3-oxazin-4-one

Systemtic Name: 5-butyl-2-(3-nitrophenyl)-6-oxidanyl-1,3-oxazin-4-one Openeye Name: 5-butyl-6-hydroxy-2-(3-nitrophenyl)-1,3-oxazin-4-one CAS Name: 5-butyl-6-hydroxy-2-(3-nitrophenyl)-1,3-oxazin-4-one IUPAC Name: 5-butyl-6-hydroxy-2-(3-nitrophenyl)-1,3-oxazin-4-one Traditional Name: 5-butyl-6-hydroxy-2-(3-nitrophenyl)-1,3-oxazin-4-one Formula: C14H14N2O5 MolecularWeight: 290.27136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(OC(=NC1=O)C2=CC(=CC=C2)[N+](=O)[O-])O

Isomeric SMILES

CCCCC1=C(OC(=NC1=O)C2=CC(=CC=C2)[N+](=O)[O-])O

InChI

InChI=1S/C14H14N2O5/c1-2-3-7-11-12(17)15-13(21-14(11)18)9-5-4-6-10(8-9)16(19)20/h4-6,8,18H,2-3,7H2,1H3