5-ethanoyl-4-methyl-4-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-oxazin-4-ium-6-olate

Systemtic Name: 5-ethanoyl-4-methyl-4-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-oxazin-4-ium-6-olate Openeye Name: 5-acetyl-4-methyl-4-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-oxazin-4-ium-6-olate CAS Name: 5-acetyl-4-methyl-4-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-oxazin-4-ium-6-olate IUPAC Name: 5-acetyl-4-methyl-4-[(4-nitrophenyl)methyl]-2,3-dihydro-1,4-oxazin-4-ium-6-olate Traditional Name: 5-acetyl-4-methyl-4-(4-nitrobenzyl)-2,3-dihydro-1,4-oxazin-4-ium-6-olate Formula: C14H16N2O5 MolecularWeight: 292.28724

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(OCC[N+]1(C)CC2=CC=C(C=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CC(=O)C1=C(OCC[N+]1(C)CC2=CC=C(C=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C14H16N2O5/c1-10(17)13-14(18)21-8-7-16(13,2)9-11-3-5-12(6-4-11)15(19)20/h3-6H,7-9H2,1-2H3