propan-2-yl 4-[5-methoxy-6-[[2-methyl-6-(2-phosphonooxyethoxy)pyridin-3-yl]amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[5-methoxy-6-[[2-methyl-6-(2-phosphonooxyethoxy)pyridin-3-yl]amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate Openeye Name: isopropyl 4-[5-methoxy-6-[[2-methyl-6-(2-phosphonooxyethoxy)-3-pyridyl]amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate CAS Name: 4-[[5-methoxy-6-[[2-methyl-6-(2-phosphonooxyethoxy)-3-pyridinyl]amino]-4-pyrimidinyl]oxy]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[5-methoxy-6-[[2-methyl-6-(2-phosphonooxyethoxy)pyridin-3-yl]amino]pyrimidin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[5-methoxy-6-[[2-methyl-6-(2-phosphonooxyethoxy)-3-pyridyl]amino]pyrimidin-4-yl]oxypiperidine-1-carboxylic acid isopropyl ester Formula: C22H32N5O9P MolecularWeight: 541.491341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)OCCOP(=O)(O)O)NC2=C(C(=NC=N2)OC3CCN(CC3)C(=O)OC(C)C)OC

Isomeric SMILES

CC1=C(C=CC(=N1)OCCOP(=O)(O)O)NC2=C(C(=NC=N2)OC3CCN(CC3)C(=O)OC(C)C)OC

InChI

InChI=1S/C22H32N5O9P/c1-14(2)35-22(28)27-9-7-16(8-10-27)36-21-19(32-4)20(23-13-24-21)26-17-5-6-18(25-15(17)3)33-11-12-34-37(29,30)31/h5-6,13-14,16H,7-12H2,1-4H3,(H,23,24,26)(H2,29,30,31)