3-[[4-(2-oxidanylideneimidazolidin-1-yl)piperidin-1-yl]methyl]-2-phenyl-quinoline-4-carboxylic acid

Systemtic Name: 3-[[4-(2-oxidanylideneimidazolidin-1-yl)piperidin-1-yl]methyl]-2-phenyl-quinoline-4-carboxylic acid Openeye Name: 3-[[4-(2-oxoimidazolidin-1-yl)-1-piperidyl]methyl]-2-phenyl-quinoline-4-carboxylic acid CAS Name: 3-[[4-(2-oxo-1-imidazolidinyl)-1-piperidinyl]methyl]-2-phenyl-4-quinolinecarboxylic acid IUPAC Name: 3-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]-2-phenylquinoline-4-carboxylic acid Traditional Name: 3-[[4-(2-ketoimidazolidin-1-yl)piperidino]methyl]-2-phenyl-cinchoninic acid Formula: C25H26N4O3 MolecularWeight: 430.49894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CCNC2=O)CC3=C(C4=CC=CC=C4N=C3C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1CN(CCC1N2CCNC2=O)CC3=C(C4=CC=CC=C4N=C3C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C25H26N4O3/c30-24(31)22-19-8-4-5-9-21(19)27-23(17-6-2-1-3-7-17)20(22)16-28-13-10-18(11-14-28)29-15-12-26-25(29)32/h1-9,18H,10-16H2,(H,26,32)(H,30,31)