8-oxidanyl-8-(2-pentoxyquinolin-3-yl)oct-5-ynoic acid

Systemtic Name: 8-oxidanyl-8-(2-pentoxyquinolin-3-yl)oct-5-ynoic acid Openeye Name: 8-hydroxy-8-(2-pentoxy-3-quinolyl)oct-5-ynoic acid CAS Name: 8-hydroxy-8-(2-pentoxy-3-quinolinyl)-5-octynoic acid IUPAC Name: 8-hydroxy-8-(2-pentoxyquinolin-3-yl)oct-5-ynoic acid Traditional Name: 8-(2-amoxy-3-quinolyl)-8-hydroxy-oct-5-ynoic acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=NC2=CC=CC=C2C=C1C(CC#CCCCC(=O)O)O

Isomeric SMILES

CCCCCOC1=NC2=CC=CC=C2C=C1C(CC#CCCCC(=O)O)O

InChI

InChI=1S/C22H27NO4/c1-2-3-10-15-27-22-18(16-17-11-8-9-12-19(17)23-22)20(24)13-6-4-5-7-14-21(25)26/h8-9,11-12,16,20,24H,2-3,5,7,10,13-15H2,1H3,(H,25,26)