4-[(5-chloranyl-6-ethyl-pyrimidin-4-yl)amino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[(5-chloranyl-6-ethyl-pyrimidin-4-yl)amino]cyclohexane-1-carboxylic acid Openeye Name: 4-[(5-chloro-6-ethyl-pyrimidin-4-yl)amino]cyclohexanecarboxylic acid CAS Name: 4-[(5-chloro-6-ethyl-4-pyrimidinyl)amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[(5-chloro-6-ethylpyrimidin-4-yl)amino]cyclohexane-1-carboxylic acid Traditional Name: 4-[(5-chloro-6-ethyl-pyrimidin-4-yl)amino]cyclohexanecarboxylic acid Formula: C13H18ClN3O2 MolecularWeight: 283.75392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC=N1)NC2CCC(CC2)C(=O)O)Cl

Isomeric SMILES

CCC1=C(C(=NC=N1)NC2CCC(CC2)C(=O)O)Cl

InChI

InChI=1S/C13H18ClN3O2/c1-2-10-11(14)12(16-7-15-10)17-9-5-3-8(4-6-9)13(18)19/h7-9H,2-6H2,1H3,(H,18,19)(H,15,16,17)