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

Systemtic Name: 2-(2-methylpyrimidin-5-yl)-7-oxidanylidene-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Openeye Name: 2-(2-methylpyrimidin-5-yl)-7-oxo-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid CAS Name: 2-(2-methyl-5-pyrimidinyl)-7-oxo-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid IUPAC Name: 2-(2-methylpyrimidin-5-yl)-7-oxo-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Traditional Name: 7-keto-2-(2-methylpyrimidin-5-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pelargonic acid Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=N1)C(CCCCC(=O)CCC2=NC3=C(CCCN3)C=C2)C(=O)O

Isomeric SMILES

CC1=NC=C(C=N1)C(CCCCC(=O)CCC2=NC3=C(CCCN3)C=C2)C(=O)O

InChI

InChI=1S/C22H28N4O3/c1-15-24-13-17(14-25-15)20(22(28)29)7-3-2-6-19(27)11-10-18-9-8-16-5-4-12-23-21(16)26-18/h8-9,13-14,20H,2-7,10-12H2,1H3,(H,23,26)(H,28,29)