4-(4-chloranyl-3-methyl-phenoxy)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine Openeye Name: 4-(4-chloro-3-methyl-phenoxy)-6-(4-isopropylphenoxy)-5-nitro-pyrimidine CAS Name: 4-(4-chloro-3-methylphenoxy)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine IUPAC Name: 4-(4-chloro-3-methylphenoxy)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine Traditional Name: 4-(4-chloro-3-methyl-phenoxy)-6-(4-isopropylphenoxy)-5-nitro-pyrimidine Formula: C20H18ClN3O4 MolecularWeight: 399.82762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])OC3=CC=C(C=C3)C(C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC=NC(=C2[N+](=O)[O-])OC3=CC=C(C=C3)C(C)C)Cl

InChI

InChI=1S/C20H18ClN3O4/c1-12(2)14-4-6-15(7-5-14)27-19-18(24(25)26)20(23-11-22-19)28-16-8-9-17(21)13(3)10-16/h4-12H,1-3H3