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

Systemtic Name: 3-(2-methoxypyrimidin-5-yl)-5-oxidanylidene-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Openeye Name: 3-(2-methoxypyrimidin-5-yl)-5-oxo-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid CAS Name: 3-(2-methoxy-5-pyrimidinyl)-5-oxo-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid IUPAC Name: 3-(2-methoxypyrimidin-5-yl)-5-oxo-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Traditional Name: 5-keto-3-(2-methoxypyrimidin-5-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pelargonic acid Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=N1)C(CC(=O)CCCCC2=NC3=C(CCCN3)C=C2)CC(=O)O

Isomeric SMILES

COC1=NC=C(C=N1)C(CC(=O)CCCCC2=NC3=C(CCCN3)C=C2)CC(=O)O

InChI

InChI=1S/C22H28N4O4/c1-30-22-24-13-17(14-25-22)16(12-20(28)29)11-19(27)7-3-2-6-18-9-8-15-5-4-10-23-21(15)26-18/h8-9,13-14,16H,2-7,10-12H2,1H3,(H,23,26)(H,28,29)