3-(1-methylpyrazol-4-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid

Systemtic Name: 3-(1-methylpyrazol-4-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Openeye Name: 3-(1-methylpyrazol-4-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid CAS Name: 3-(1-methyl-4-pyrazolyl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid IUPAC Name: 3-(1-methylpyrazol-4-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Traditional Name: 3-(1-methylpyrazol-4-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pelargonic acid Formula: C21H30N4O2 MolecularWeight: 370.4885

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(CCCCCCC2=NC3=C(CCCN3)C=C2)CC(=O)O

Isomeric SMILES

CN1C=C(C=N1)C(CCCCCCC2=NC3=C(CCCN3)C=C2)CC(=O)O

InChI

InChI=1S/C21H30N4O2/c1-25-15-18(14-23-25)17(13-20(26)27)7-4-2-3-5-9-19-11-10-16-8-6-12-22-21(16)24-19/h10-11,14-15,17H,2-9,12-13H2,1H3,(H,22,24)(H,26,27)