3-[4-(2-aminocarbonylphenyl)phenoxy]-2-propyl-quinoline-4-carboxylic acid

Systemtic Name: 3-[4-(2-aminocarbonylphenyl)phenoxy]-2-propyl-quinoline-4-carboxylic acid Openeye Name: 3-[4-(2-carbamoylphenyl)phenoxy]-2-propyl-quinoline-4-carboxylic acid CAS Name: 3-[4-(2-carbamoylphenyl)phenoxy]-2-propyl-4-quinolinecarboxylic acid IUPAC Name: 3-[4-(2-carbamoylphenyl)phenoxy]-2-propylquinoline-4-carboxylic acid Traditional Name: 3-[4-(2-carbamoylphenyl)phenoxy]-2-propyl-cinchoninic acid Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=C1OC3=CC=C(C=C3)C4=CC=CC=C4C(=O)N)C(=O)O

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=C1OC3=CC=C(C=C3)C4=CC=CC=C4C(=O)N)C(=O)O

InChI

InChI=1S/C26H22N2O4/c1-2-7-22-24(23(26(30)31)20-10-5-6-11-21(20)28-22)32-17-14-12-16(13-15-17)18-8-3-4-9-19(18)25(27)29/h3-6,8-15H,2,7H2,1H3,(H2,27,29)(H,30,31)