7-[[2-(4-propoxyphenyl)phenyl]carbonylamino]quinoline-3-carboxylic acid

Systemtic Name: 7-[[2-(4-propoxyphenyl)phenyl]carbonylamino]quinoline-3-carboxylic acid Openeye Name: 7-[[2-(4-propoxyphenyl)benzoyl]amino]quinoline-3-carboxylic acid CAS Name: 7-[[oxo-[2-(4-propoxyphenyl)phenyl]methyl]amino]-3-quinolinecarboxylic acid IUPAC Name: 7-[[2-(4-propoxyphenyl)benzoyl]amino]quinoline-3-carboxylic acid Traditional Name: 7-[[2-(4-propoxyphenyl)benzoyl]amino]quinoline-3-carboxylic acid Formula: C26H22N2O4 MolecularWeight: 426.46388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC4=NC=C(C=C4C=C3)C(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC4=NC=C(C=C4C=C3)C(=O)O

InChI

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