4-[(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)amino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)amino]cyclohexane-1-carboxylic acid Openeye Name: 4-[(2-chloro-5-fluoro-pyrimidin-4-yl)amino]cyclohexanecarboxylic acid CAS Name: 4-[(2-chloro-5-fluoro-4-pyrimidinyl)amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[(2-chloro-5-fluoropyrimidin-4-yl)amino]cyclohexane-1-carboxylic acid Traditional Name: 4-[(2-chloro-5-fluoro-pyrimidin-4-yl)amino]cyclohexanecarboxylic acid Formula: C11H13ClFN3O2 MolecularWeight: 273.691223

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)O)NC2=NC(=NC=C2F)Cl

Isomeric SMILES

C1CC(CCC1C(=O)O)NC2=NC(=NC=C2F)Cl

InChI

InChI=1S/C11H13ClFN3O2/c12-11-14-5-8(13)9(16-11)15-7-3-1-6(2-4-7)10(17)18/h5-7H,1-4H2,(H,17,18)(H,14,15,16)