ethyl (1S,2S)-2-[(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)amino]cyclopentane-1-carboxylate

Systemtic Name: ethyl (1S,2S)-2-[(2-chloranyl-5-fluoranyl-pyrimidin-4-yl)amino]cyclopentane-1-carboxylate Openeye Name: ethyl (1S,2S)-2-[(2-chloro-5-fluoro-pyrimidin-4-yl)amino]cyclopentanecarboxylate CAS Name: (1S,2S)-2-[(2-chloro-5-fluoro-4-pyrimidinyl)amino]-1-cyclopentanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2S)-2-[(2-chloro-5-fluoropyrimidin-4-yl)amino]cyclopentane-1-carboxylate Traditional Name: (1S,2S)-2-[(2-chloro-5-fluoro-pyrimidin-4-yl)amino]cyclopentanecarboxylic acid ethyl ester Formula: C12H15ClFN3O2 MolecularWeight: 287.717803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC1NC2=NC(=NC=C2F)Cl

Isomeric SMILES

CCOC(=O)[C@H]1CCC[C@@H]1NC2=NC(=NC=C2F)Cl

InChI

InChI=1S/C12H15ClFN3O2/c1-2-19-11(18)7-4-3-5-9(7)16-10-8(14)6-15-12(13)17-10/h6-7,9H,2-5H2,1H3,(H,15,16,17)/t7-,9-/m0/s1