N-[2,3-bis(chloranyl)phenyl]-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-amine

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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