5-ethanoyl-4,4-bis(3-methylbut-2-enyl)-2,3-dihydro-1,4-oxazin-4-ium-6-olate

Systemtic Name: 5-ethanoyl-4,4-bis(3-methylbut-2-enyl)-2,3-dihydro-1,4-oxazin-4-ium-6-olate Openeye Name: 5-acetyl-4,4-bis(3-methylbut-2-enyl)-2,3-dihydro-1,4-oxazin-4-ium-6-olate CAS Name: 5-acetyl-4,4-bis(3-methylbut-2-enyl)-2,3-dihydro-1,4-oxazin-4-ium-6-olate IUPAC Name: 5-acetyl-4,4-bis(3-methylbut-2-enyl)-2,3-dihydro-1,4-oxazin-4-ium-6-olate Traditional Name: 5-acetyl-4,4-bis(3-methylbut-2-enyl)-2,3-dihydro-1,4-oxazin-4-ium-6-olate Formula: C16H25NO3 MolecularWeight: 279.3746

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC[N+]1(CCOC(=C1C(=O)C)[O-])CC=C(C)C)C

Isomeric SMILES

CC(=CC[N+]1(CCOC(=C1C(=O)C)[O-])CC=C(C)C)C

InChI

InChI=1S/C16H25NO3/c1-12(2)6-8-17(9-7-13(3)4)10-11-20-16(19)15(17)14(5)18/h6-7H,8-11H2,1-5H3