sodium 8-(7-methoxy-3-phenyl-quinolin-2-yl)oxyoctanoate

Systemtic Name: sodium 8-(7-methoxy-3-phenyl-quinolin-2-yl)oxyoctanoate Openeye Name: sodium 8-[(7-methoxy-3-phenyl-2-quinolyl)oxy]octanoate CAS Name: sodium 8-[(7-methoxy-3-phenyl-2-quinolinyl)oxy]octanoate IUPAC Name: sodium 8-(7-methoxy-3-phenylquinolin-2-yl)oxyoctanoate Traditional Name: sodium 8-[(7-methoxy-3-phenyl-2-quinolyl)oxy]caprylate Formula: C24H26NNaO4 MolecularWeight: 415.45731

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)C3=CC=CC=C3)OCCCCCCCC(=O)[O-].[Na+]

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)C3=CC=CC=C3)OCCCCCCCC(=O)[O-].[Na+]

InChI

InChI=1S/C24H27NO4.Na/c1-28-20-14-13-19-16-21(18-10-6-5-7-11-18)24(25-22(19)17-20)29-15-9-4-2-3-8-12-23(26)27;/h5-7,10-11,13-14,16-17H,2-4,8-9,12,15H2,1H3,(H,26,27);/q;+1/p-1