3-azanyl-2-(4-phenoxyphenyl)quinoline-4-carboxylic acid

Systemtic Name: 3-azanyl-2-(4-phenoxyphenyl)quinoline-4-carboxylic acid Openeye Name: 3-amino-2-(4-phenoxyphenyl)quinoline-4-carboxylic acid CAS Name: 3-amino-2-(4-phenoxyphenyl)-4-quinolinecarboxylic acid IUPAC Name: 3-amino-2-(4-phenoxyphenyl)quinoline-4-carboxylic acid Traditional Name: 3-amino-2-(4-phenoxyphenyl)cinchoninic acid Formula: C22H16N2O3 MolecularWeight: 356.37404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=C3N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=C3N)C(=O)O

InChI

InChI=1S/C22H16N2O3/c23-20-19(22(25)26)17-8-4-5-9-18(17)24-21(20)14-10-12-16(13-11-14)27-15-6-2-1-3-7-15/h1-13H,23H2,(H,25,26)