4-(3,5-dimethylpyrazol-1-yl)-6-(4-ethylphenoxy)-5-nitro-pyrimidine

Systemtic Name: 4-(3,5-dimethylpyrazol-1-yl)-6-(4-ethylphenoxy)-5-nitro-pyrimidine Openeye Name: 4-(3,5-dimethylpyrazol-1-yl)-6-(4-ethylphenoxy)-5-nitro-pyrimidine CAS Name: 4-(3,5-dimethyl-1-pyrazolyl)-6-(4-ethylphenoxy)-5-nitropyrimidine IUPAC Name: 4-(3,5-dimethylpyrazol-1-yl)-6-(4-ethylphenoxy)-5-nitropyrimidine Traditional Name: 4-(3,5-dimethylpyrazol-1-yl)-6-(4-ethylphenoxy)-5-nitro-pyrimidine Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3C(=CC(=N3)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3C(=CC(=N3)C)C

InChI

InChI=1S/C17H17N5O3/c1-4-13-5-7-14(8-6-13)25-17-15(22(23)24)16(18-10-19-17)21-12(3)9-11(2)20-21/h5-10H,4H2,1-3H3