6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-N-pyridin-3-yl-pyrimidin-4-amine

Systemtic Name: 6-(4-chloranyl-3-methyl-phenoxy)-5-nitro-N-pyridin-3-yl-pyrimidin-4-amine Openeye Name: 6-(4-chloro-3-methyl-phenoxy)-5-nitro-N-(3-pyridyl)pyrimidin-4-amine CAS Name: 6-(4-chloro-3-methylphenoxy)-5-nitro-N-(3-pyridinyl)-4-pyrimidinamine IUPAC Name: 6-(4-chloro-3-methylphenoxy)-5-nitro-N-pyridin-3-ylpyrimidin-4-amine Traditional Name: [6-(4-chloro-3-methyl-phenoxy)-5-nitro-pyrimidin-4-yl]-(3-pyridyl)amine Formula: C16H12ClN5O3 MolecularWeight: 357.75118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CN=CC=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CN=CC=C3)Cl

InChI

InChI=1S/C16H12ClN5O3/c1-10-7-12(4-5-13(10)17)25-16-14(22(23)24)15(19-9-20-16)21-11-3-2-6-18-8-11/h2-9H,1H3,(H,19,20,21)