N-(2,3-dimethylphenyl)-6-(4-methylphenoxy)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(2,3-dimethylphenyl)-6-(4-methylphenoxy)-5-nitro-pyrimidin-4-amine Openeye Name: N-(2,3-dimethylphenyl)-6-(4-methylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-(2,3-dimethylphenyl)-6-(4-methylphenoxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-(2,3-dimethylphenyl)-6-(4-methylphenoxy)-5-nitropyrimidin-4-amine Traditional Name: (2,3-dimethylphenyl)-[6-(4-methylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC(=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC(=C3C)C

InChI

InChI=1S/C19H18N4O3/c1-12-7-9-15(10-8-12)26-19-17(23(24)25)18(20-11-21-19)22-16-6-4-5-13(2)14(16)3/h4-11H,1-3H3,(H,20,21,22)