3-methyl-1-(1-oxidanidyl-5-phenyl-1,3,5-triazine-1,5-diium-2-yl)butan-2-one

Systemtic Name: 3-methyl-1-(1-oxidanidyl-5-phenyl-1,3,5-triazine-1,5-diium-2-yl)butan-2-one Openeye Name: 3-methyl-1-(1-oxido-5-phenyl-1,3,5-triazine-1,5-diium-2-yl)butan-2-one CAS Name: 3-methyl-1-(1-oxido-5-phenyl-1,3,5-triazine-1,5-diium-2-yl)-2-butanone IUPAC Name: 3-methyl-1-(1-oxido-5-phenyl-1,3,5-triazine-1,5-diium-2-yl)butan-2-one Traditional Name: 3-methyl-1-(1-oxido-5-phenyl-s-triazine-1,5-diium-2-yl)butan-2-one Formula: C14H16N3O2+ MolecularWeight: 258.29574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)CC1=[N+](C=[N+](C=N1)C2=CC=CC=C2)[O-]

Isomeric SMILES

CC(C)C(=O)CC1=[N+](C=[N+](C=N1)C2=CC=CC=C2)[O-]

InChI

InChI=1S/C14H16N3O2/c1-11(2)13(18)8-14-15-9-16(10-17(14)19)12-6-4-3-5-7-12/h3-7,9-11H,8H2,1-2H3/q+1