1-[4-(4-methyl-3-oxidanidyl-1,3,5-triazine-1,3-diium-1-yl)phenoxy]propan-2-one

Systemtic Name: 1-[4-(4-methyl-3-oxidanidyl-1,3,5-triazine-1,3-diium-1-yl)phenoxy]propan-2-one Openeye Name: 1-[4-(4-methyl-3-oxido-1,3,5-triazine-1,3-diium-1-yl)phenoxy]propan-2-one CAS Name: 1-[4-(4-methyl-3-oxido-1,3,5-triazine-1,3-diium-1-yl)phenoxy]-2-propanone IUPAC Name: 1-[4-(4-methyl-3-oxido-1,3,5-triazine-1,3-diium-1-yl)phenoxy]propan-2-one Traditional Name: 1-[4-(4-methyl-3-oxido-s-triazine-1,3-diium-1-yl)phenoxy]acetone Formula: C13H14N3O3+ MolecularWeight: 260.26856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N3O3/c1-10(17)7-19-13-5-3-12(4-6-13)15-8-14-11(2)16(18)9-15/h3-6,8-9H,7H2,1-2H3/q+1