5-chloranyl-N-[2-(4-chloranyl-2-methyl-6-nitro-phenoxy)ethyl]-6-methyl-pyrimidin-4-amine nitrate

Systemtic Name: 5-chloranyl-N-[2-(4-chloranyl-2-methyl-6-nitro-phenoxy)ethyl]-6-methyl-pyrimidin-4-amine nitrate Openeye Name: 5-chloro-N-[2-(4-chloro-2-methyl-6-nitro-phenoxy)ethyl]-6-methyl-pyrimidin-4-amine nitrate CAS Name: 5-chloro-N-[2-(4-chloro-2-methyl-6-nitrophenoxy)ethyl]-6-methyl-4-pyrimidinamine nitrate IUPAC Name: 5-chloro-N-[2-(4-chloro-2-methyl-6-nitrophenoxy)ethyl]-6-methylpyrimidin-4-amine nitrate Traditional Name: 2-(4-chloro-2-methyl-6-nitro-phenoxy)ethyl-(5-chloro-6-methyl-pyrimidin-4-yl)amine nitrate Formula: C14H14Cl2N5O6- MolecularWeight: 419.19686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCNC2=NC=NC(=C2Cl)C)[N+](=O)[O-])Cl.[N+](=O)([O-])[O-]

Isomeric SMILES

CC1=CC(=CC(=C1OCCNC2=NC=NC(=C2Cl)C)[N+](=O)[O-])Cl.[N+](=O)([O-])[O-]

InChI

InChI=1S/C14H14Cl2N4O3.NO3/c1-8-5-10(15)6-11(20(21)22)13(8)23-4-3-17-14-12(16)9(2)18-7-19-14;2-1(3)4/h5-7H,3-4H2,1-2H3,(H,17,18,19);/q;-1