N-(3,4-dichlorophenyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine

Systemtic Name: N-(3,4-dichlorophenyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine Openeye Name: N-(3,4-dichlorophenyl)-6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-(3,4-dichlorophenyl)-5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinamine IUPAC Name: N-(3,4-dichlorophenyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine Traditional Name: (3,4-dichlorophenyl)-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C19H16Cl2N4O3 MolecularWeight: 419.26134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16Cl2N4O3/c1-11(2)12-3-6-14(7-4-12)28-19-17(25(26)27)18(22-10-23-19)24-13-5-8-15(20)16(21)9-13/h3-11H,1-2H3,(H,22,23,24)