3-(2-methylpyrimidin-5-yl)-9-oxidanyl-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid

Systemtic Name: 3-(2-methylpyrimidin-5-yl)-9-oxidanyl-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Openeye Name: 9-hydroxy-3-(2-methylpyrimidin-5-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid CAS Name: 9-hydroxy-3-(2-methyl-5-pyrimidinyl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid IUPAC Name: 9-hydroxy-3-(2-methylpyrimidin-5-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Traditional Name: 9-hydroxy-3-(2-methylpyrimidin-5-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pelargonic acid Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=N1)C(CCCCCC(C2=NC3=C(CCCN3)C=C2)O)CC(=O)O

Isomeric SMILES

CC1=NC=C(C=N1)C(CCCCCC(C2=NC3=C(CCCN3)C=C2)O)CC(=O)O

InChI

InChI=1S/C22H30N4O3/c1-15-24-13-18(14-25-15)17(12-21(28)29)6-3-2-4-8-20(27)19-10-9-16-7-5-11-23-22(16)26-19/h9-10,13-14,17,20,27H,2-8,11-12H2,1H3,(H,23,26)(H,28,29)