2-[(6-octyl-3-oxidanyl-quinolin-2-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(6-octyl-3-oxidanyl-quinolin-2-yl)carbonylamino]ethanoic acid Openeye Name: 2-[(3-hydroxy-6-octyl-quinoline-2-carbonyl)amino]acetic acid CAS Name: 2-[[(3-hydroxy-6-octyl-2-quinolinyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(3-hydroxy-6-octylquinoline-2-carbonyl)amino]acetic acid Traditional Name: 2-[(3-hydroxy-6-octyl-quinoline-2-carbonyl)amino]acetic acid Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC2=CC(=C(N=C2C=C1)C(=O)NCC(=O)O)O

Isomeric SMILES

CCCCCCCCC1=CC2=CC(=C(N=C2C=C1)C(=O)NCC(=O)O)O

InChI

InChI=1S/C20H26N2O4/c1-2-3-4-5-6-7-8-14-9-10-16-15(11-14)12-17(23)19(22-16)20(26)21-13-18(24)25/h9-12,23H,2-8,13H2,1H3,(H,21,26)(H,24,25)