6-(4-chloranyl-3,5-dimethyl-phenoxy)-N-(2,4-dichlorophenyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(4-chloranyl-3,5-dimethyl-phenoxy)-N-(2,4-dichlorophenyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-chloro-3,5-dimethyl-phenoxy)-N-(2,4-dichlorophenyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-chloro-3,5-dimethylphenoxy)-N-(2,4-dichlorophenyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(4-chloro-3,5-dimethylphenoxy)-N-(2,4-dichlorophenyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-pyrimidin-4-yl]-(2,4-dichlorophenyl)amine Formula: C18H13Cl3N4O3 MolecularWeight: 439.67982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H13Cl3N4O3/c1-9-5-12(6-10(2)15(9)21)28-18-16(25(26)27)17(22-8-23-18)24-14-4-3-11(19)7-13(14)20/h3-8H,1-2H3,(H,22,23,24)