N-(3-chloranyl-4-fluoranyl-phenyl)-6-cyclohexyloxy-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-6-cyclohexyloxy-5-nitro-pyrimidin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-6-(cyclohexoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-6-cyclohexyloxy-5-nitro-4-pyrimidinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-6-cyclohexyloxy-5-nitropyrimidin-4-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-[6-(cyclohexoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C16H16ClFN4O3 MolecularWeight: 366.774643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CCC(CC1)OC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C16H16ClFN4O3/c17-12-8-10(6-7-13(12)18)21-15-14(22(23)24)16(20-9-19-15)25-11-4-2-1-3-5-11/h6-9,11H,1-5H2,(H,19,20,21)