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

Systemtic Name: 3-(6-oxidanylidene-1H-pyridin-3-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Openeye Name: 3-(6-oxo-1H-pyridin-3-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid CAS Name: 3-(6-oxo-1H-pyridin-3-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid IUPAC Name: 3-(6-oxo-1H-pyridin-3-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Traditional Name: 3-(6-keto-1H-pyridin-3-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pelargonic acid Formula: C22H29N3O3 MolecularWeight: 383.48396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(NC1)N=C(C=C2)CCCCCCC(CC(=O)O)C3=CNC(=O)C=C3

Isomeric SMILES

C1CC2=C(NC1)N=C(C=C2)CCCCCCC(CC(=O)O)C3=CNC(=O)C=C3

InChI

InChI=1S/C22H29N3O3/c26-20-12-10-18(15-24-20)17(14-21(27)28)6-3-1-2-4-8-19-11-9-16-7-5-13-23-22(16)25-19/h9-12,15,17H,1-8,13-14H2,(H,23,25)(H,24,26)(H,27,28)