3-(2-methoxypyrimidin-5-yl)-9-[5-methyl-6-(methylamino)pyridin-2-yl]nonanoic acid

Systemtic Name: 3-(2-methoxypyrimidin-5-yl)-9-[5-methyl-6-(methylamino)pyridin-2-yl]nonanoic acid Openeye Name: 3-(2-methoxypyrimidin-5-yl)-9-[5-methyl-6-(methylamino)-2-pyridyl]nonanoic acid CAS Name: 3-(2-methoxy-5-pyrimidinyl)-9-[5-methyl-6-(methylamino)-2-pyridinyl]nonanoic acid IUPAC Name: 3-(2-methoxypyrimidin-5-yl)-9-[5-methyl-6-(methylamino)pyridin-2-yl]nonanoic acid Traditional Name: 3-(2-methoxypyrimidin-5-yl)-9-[5-methyl-6-(methylamino)-2-pyridyl]pelargonic acid Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C=C1)CCCCCCC(CC(=O)O)C2=CN=C(N=C2)OC)NC

Isomeric SMILES

CC1=C(N=C(C=C1)CCCCCCC(CC(=O)O)C2=CN=C(N=C2)OC)NC

InChI

InChI=1S/C21H30N4O3/c1-15-10-11-18(25-20(15)22-2)9-7-5-4-6-8-16(12-19(26)27)17-13-23-21(28-3)24-14-17/h10-11,13-14,16H,4-9,12H2,1-3H3,(H,22,25)(H,26,27)