3-methyl-2-morpholin-4-yl-2-[6-(4,5,6,7-tetrahydrobenzimidazol-1-yl)pyridin-3-yl]pentanedioic acid

Systemtic Name: 3-methyl-2-morpholin-4-yl-2-[6-(4,5,6,7-tetrahydrobenzimidazol-1-yl)pyridin-3-yl]pentanedioic acid Openeye Name: 3-methyl-2-morpholino-2-[6-(4,5,6,7-tetrahydrobenzimidazol-1-yl)-3-pyridyl]pentanedioic acid CAS Name: 3-methyl-2-(4-morpholinyl)-2-[6-(4,5,6,7-tetrahydrobenzimidazol-1-yl)-3-pyridinyl]pentanedioic acid IUPAC Name: 3-methyl-2-morpholin-4-yl-2-[6-(4,5,6,7-tetrahydrobenzimidazol-1-yl)pyridin-3-yl]pentanedioic acid Traditional Name: 3-methyl-2-morpholino-2-[6-(4,5,6,7-tetrahydrobenzimidazol-1-yl)-3-pyridyl]glutaric acid Formula: C22H28N4O5 MolecularWeight: 428.48152

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C(C1=CN=C(C=C1)N2C=NC3=C2CCCC3)(C(=O)O)N4CCOCC4

Isomeric SMILES

CC(CC(=O)O)C(C1=CN=C(C=C1)N2C=NC3=C2CCCC3)(C(=O)O)N4CCOCC4

InChI

InChI=1S/C22H28N4O5/c1-15(12-20(27)28)22(21(29)30,25-8-10-31-11-9-25)16-6-7-19(23-13-16)26-14-24-17-4-2-3-5-18(17)26/h6-7,13-15H,2-5,8-12H2,1H3,(H,27,28)(H,29,30)