4-imidazol-1-yl-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine

Systemtic Name: 4-imidazol-1-yl-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine Openeye Name: 4-imidazol-1-yl-6-(4-isopropylphenoxy)-5-nitro-pyrimidine CAS Name: 4-(1-imidazolyl)-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine IUPAC Name: 4-imidazol-1-yl-5-nitro-6-(4-propan-2-ylphenoxy)pyrimidine Traditional Name: 4-imidazol-1-yl-6-(4-isopropylphenoxy)-5-nitro-pyrimidine Formula: C16H15N5O3 MolecularWeight: 325.322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3C=CN=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3C=CN=C3

InChI

InChI=1S/C16H15N5O3/c1-11(2)12-3-5-13(6-4-12)24-16-14(21(22)23)15(18-9-19-16)20-8-7-17-10-20/h3-11H,1-2H3