8-methyl-4-(4-nonylphenoxy)quinoline-2-carboxylic acid

Systemtic Name: 8-methyl-4-(4-nonylphenoxy)quinoline-2-carboxylic acid Openeye Name: 8-methyl-4-(4-nonylphenoxy)quinoline-2-carboxylic acid CAS Name: 8-methyl-4-(4-nonylphenoxy)-2-quinolinecarboxylic acid IUPAC Name: 8-methyl-4-(4-nonylphenoxy)quinoline-2-carboxylic acid Traditional Name: 8-methyl-4-(4-nonylphenoxy)quinaldic acid Formula: C26H31NO3 MolecularWeight: 405.52924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)OC2=CC(=NC3=C2C=CC=C3C)C(=O)O

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)OC2=CC(=NC3=C2C=CC=C3C)C(=O)O

InChI

InChI=1S/C26H31NO3/c1-3-4-5-6-7-8-9-12-20-14-16-21(17-15-20)30-24-18-23(26(28)29)27-25-19(2)11-10-13-22(24)25/h10-11,13-18H,3-9,12H2,1-2H3,(H,28,29)