N2-[(2-methoxyphenyl)methyl]-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-[(2-methoxyphenyl)methyl]-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-[(2-methoxyphenyl)methyl]-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-[(2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-[(2-methoxyphenyl)methyl]-5-nitropyrimidine-2,4-diamine Traditional Name: (4-amino-5-nitro-pyrimidin-2-yl)-o-anisyl-amine Formula: C12H13N5O3 MolecularWeight: 275.26332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC2=NC=C(C(=N2)N)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1CNC2=NC=C(C(=N2)N)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O3/c1-20-10-5-3-2-4-8(10)6-14-12-15-7-9(17(18)19)11(13)16-12/h2-5,7H,6H2,1H3,(H3,13,14,15,16)