2-(4-heptylphenyl)quinoline-4,8-dicarboxylic acid

Systemtic Name: 2-(4-heptylphenyl)quinoline-4,8-dicarboxylic acid Openeye Name: 2-(4-heptylphenyl)quinoline-4,8-dicarboxylic acid CAS Name: 2-(4-heptylphenyl)quinoline-4,8-dicarboxylic acid IUPAC Name: 2-(4-heptylphenyl)quinoline-4,8-dicarboxylic acid Traditional Name: 2-(4-heptylphenyl)quinoline-4,8-dicarboxylic acid Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=NC3=C(C=CC=C3C(=O)O)C(=C2)C(=O)O

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=NC3=C(C=CC=C3C(=O)O)C(=C2)C(=O)O

InChI

InChI=1S/C24H25NO4/c1-2-3-4-5-6-8-16-11-13-17(14-12-16)21-15-20(24(28)29)18-9-7-10-19(23(26)27)22(18)25-21/h7,9-15H,2-6,8H2,1H3,(H,26,27)(H,28,29)