4-(4-chloranyl-3,5-dimethyl-phenoxy)-6-(2-ethylpiperidin-1-yl)-5-nitro-pyrimidine

Systemtic Name: 4-(4-chloranyl-3,5-dimethyl-phenoxy)-6-(2-ethylpiperidin-1-yl)-5-nitro-pyrimidine Openeye Name: 4-(4-chloro-3,5-dimethyl-phenoxy)-6-(2-ethyl-1-piperidyl)-5-nitro-pyrimidine CAS Name: 4-(4-chloro-3,5-dimethylphenoxy)-6-(2-ethyl-1-piperidinyl)-5-nitropyrimidine IUPAC Name: 4-(4-chloro-3,5-dimethylphenoxy)-6-(2-ethylpiperidin-1-yl)-5-nitropyrimidine Traditional Name: 4-(4-chloro-3,5-dimethyl-phenoxy)-6-(2-ethylpiperidino)-5-nitro-pyrimidine Formula: C19H23ClN4O3 MolecularWeight: 390.86392

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C(=NC=N2)OC3=CC(=C(C(=C3)C)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C2=C(C(=NC=N2)OC3=CC(=C(C(=C3)C)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C19H23ClN4O3/c1-4-14-7-5-6-8-23(14)18-17(24(25)26)19(22-11-21-18)27-15-9-12(2)16(20)13(3)10-15/h9-11,14H,4-8H2,1-3H3