N-(3-chlorophenyl)-6-(3,4-dimethylphenoxy)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(3-chlorophenyl)-6-(3,4-dimethylphenoxy)-5-nitro-pyrimidin-4-amine Openeye Name: N-(3-chlorophenyl)-6-(3,4-dimethylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-(3-chlorophenyl)-6-(3,4-dimethylphenoxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-(3-chlorophenyl)-6-(3,4-dimethylphenoxy)-5-nitropyrimidin-4-amine Traditional Name: (3-chlorophenyl)-[6-(3,4-dimethylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C18H15ClN4O3 MolecularWeight: 370.7897

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClN4O3/c1-11-6-7-15(8-12(11)2)26-18-16(23(24)25)17(20-10-21-18)22-14-5-3-4-13(19)9-14/h3-10H,1-2H3,(H,20,21,22)