2-(dimethylamino)-4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]oxy-pyrimidine-5-carboxylic acid

Systemtic Name: 2-(dimethylamino)-4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]oxy-pyrimidine-5-carboxylic acid Openeye Name: 4-[4-(tert-butoxycarbonylamino)cyclohexoxy]-2-(dimethylamino)pyrimidine-5-carboxylic acid CAS Name: 2-(dimethylamino)-4-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]cyclohexyl]oxy-5-pyrimidinecarboxylic acid IUPAC Name: 2-(dimethylamino)-4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexyl]oxypyrimidine-5-carboxylic acid Traditional Name: 4-[4-(tert-butoxycarbonylamino)cyclohexoxy]-2-(dimethylamino)pyrimidine-5-carboxylic acid Formula: C18H28N4O5 MolecularWeight: 380.43872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCC(CC1)OC2=NC(=NC=C2C(=O)O)N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCC(CC1)OC2=NC(=NC=C2C(=O)O)N(C)C

InChI

InChI=1S/C18H28N4O5/c1-18(2,3)27-17(25)20-11-6-8-12(9-7-11)26-14-13(15(23)24)10-19-16(21-14)22(4)5/h10-12H,6-9H2,1-5H3,(H,20,25)(H,23,24)