4-(7-chloranylquinolin-4-yl)-N-(4-ethanoylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(7-chloranylquinolin-4-yl)-N-(4-ethanoylphenyl)piperazine-1-carboxamide Openeye Name: N-(4-acetylphenyl)-4-(7-chloro-4-quinolyl)piperazine-1-carboxamide CAS Name: N-(4-acetylphenyl)-4-(7-chloro-4-quinolinyl)-1-piperazinecarboxamide IUPAC Name: N-(4-acetylphenyl)-4-(7-chloroquinolin-4-yl)piperazine-1-carboxamide Traditional Name: N-(4-acetylphenyl)-4-(7-chloro-4-quinolyl)piperazine-1-carboxamide Formula: C22H21ClN4O2 MolecularWeight: 408.88074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C22H21ClN4O2/c1-15(28)16-2-5-18(6-3-16)25-22(29)27-12-10-26(11-13-27)21-8-9-24-20-14-17(23)4-7-19(20)21/h2-9,14H,10-13H2,1H3,(H,25,29)