N-(5-chloranyl-3-decyl-8-oxidanyl-2-undecyl-quinolin-7-yl)benzamide

Systemtic Name: N-(5-chloranyl-3-decyl-8-oxidanyl-2-undecyl-quinolin-7-yl)benzamide Openeye Name: N-(5-chloro-3-decyl-8-hydroxy-2-undecyl-7-quinolyl)benzamide CAS Name: N-(5-chloro-3-decyl-8-hydroxy-2-undecyl-7-quinolinyl)benzamide IUPAC Name: N-(5-chloro-3-decyl-8-hydroxy-2-undecylquinolin-7-yl)benzamide Traditional Name: N-(5-chloro-3-decyl-8-hydroxy-2-undecyl-7-quinolyl)benzamide Formula: C37H53ClN2O2 MolecularWeight: 593.28192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=C(C=C2C(=CC(=C(C2=N1)O)NC(=O)C3=CC=CC=C3)Cl)CCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCC1=C(C=C2C(=CC(=C(C2=N1)O)NC(=O)C3=CC=CC=C3)Cl)CCCCCCCCCC

InChI

InChI=1S/C37H53ClN2O2/c1-3-5-7-9-11-13-15-17-22-26-33-30(25-19-16-14-12-10-8-6-4-2)27-31-32(38)28-34(36(41)35(31)39-33)40-37(42)29-23-20-18-21-24-29/h18,20-21,23-24,27-28,41H,3-17,19,22,25-26H2,1-2H3,(H,40,42)