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

Systemtic Name: 3-(2-tert-butylpyrimidin-5-yl)-5-oxidanylidene-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Openeye Name: 3-(2-tert-butylpyrimidin-5-yl)-5-oxo-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid CAS Name: 3-(2-tert-butyl-5-pyrimidinyl)-5-oxo-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid IUPAC Name: 3-(2-tert-butylpyrimidin-5-yl)-5-oxo-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Traditional Name: 3-(2-tert-butylpyrimidin-5-yl)-5-keto-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pelargonic acid Formula: C25H34N4O3 MolecularWeight: 438.56246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC=C(C=N1)C(CC(=O)CCCCC2=NC3=C(CCCN3)C=C2)CC(=O)O

Isomeric SMILES

CC(C)(C)C1=NC=C(C=N1)C(CC(=O)CCCCC2=NC3=C(CCCN3)C=C2)CC(=O)O

InChI

InChI=1S/C25H34N4O3/c1-25(2,3)24-27-15-19(16-28-24)18(14-22(31)32)13-21(30)9-5-4-8-20-11-10-17-7-6-12-26-23(17)29-20/h10-11,15-16,18H,4-9,12-14H2,1-3H3,(H,26,29)(H,31,32)