N,2,6-trimethyl-N-[(3-nitrophenyl)methyl]pyrimidin-3-ium-4-amine

Systemtic Name: N,2,6-trimethyl-N-[(3-nitrophenyl)methyl]pyrimidin-3-ium-4-amine Openeye Name: N,2,6-trimethyl-N-[(3-nitrophenyl)methyl]pyrimidin-3-ium-4-amine CAS Name: N,2,6-trimethyl-N-[(3-nitrophenyl)methyl]-4-pyrimidin-3-iumamine IUPAC Name: N,2,6-trimethyl-N-[(3-nitrophenyl)methyl]pyrimidin-3-ium-4-amine Traditional Name: (2,6-dimethylpyrimidin-3-ium-4-yl)-methyl-(3-nitrobenzyl)amine Formula: C14H17N4O2+ MolecularWeight: 273.31038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)C)N(C)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)C)N(C)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O2/c1-10-7-14(16-11(2)15-10)17(3)9-12-5-4-6-13(8-12)18(19)20/h4-8H,9H2,1-3H3/p+1