4-(3,5-dimethylphenoxy)-6-(3-methylpiperidin-1-yl)-5-nitro-pyrimidine

Systemtic Name: 4-(3,5-dimethylphenoxy)-6-(3-methylpiperidin-1-yl)-5-nitro-pyrimidine Openeye Name: 4-(3,5-dimethylphenoxy)-6-(3-methyl-1-piperidyl)-5-nitro-pyrimidine CAS Name: 4-(3,5-dimethylphenoxy)-6-(3-methyl-1-piperidinyl)-5-nitropyrimidine IUPAC Name: 4-(3,5-dimethylphenoxy)-6-(3-methylpiperidin-1-yl)-5-nitropyrimidine Traditional Name: 4-(3,5-dimethylphenoxy)-6-(3-methylpiperidino)-5-nitro-pyrimidine Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C(=NC=N2)OC3=CC(=CC(=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C(=NC=N2)OC3=CC(=CC(=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O3/c1-12-5-4-6-21(10-12)17-16(22(23)24)18(20-11-19-17)25-15-8-13(2)7-14(3)9-15/h7-9,11-12H,4-6,10H2,1-3H3