N-[4-[4-(4-methoxyquinolin-2-yl)carbonylpiperazin-1-yl]phenyl]dodecanamide

Systemtic Name: N-[4-[4-(4-methoxyquinolin-2-yl)carbonylpiperazin-1-yl]phenyl]dodecanamide Openeye Name: N-[4-[4-(4-methoxyquinoline-2-carbonyl)piperazin-1-yl]phenyl]dodecanamide CAS Name: N-[4-[4-[(4-methoxy-2-quinolinyl)-oxomethyl]-1-piperazinyl]phenyl]dodecanamide IUPAC Name: N-[4-[4-(4-methoxyquinoline-2-carbonyl)piperazin-1-yl]phenyl]dodecanamide Traditional Name: N-[4-[4-(4-methoxyquinoline-2-carbonyl)piperazino]phenyl]lauramide Formula: C33H44N4O3 MolecularWeight: 544.72746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C(=C3)OC

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C(=C3)OC

InChI

InChI=1S/C33H44N4O3/c1-3-4-5-6-7-8-9-10-11-16-32(38)34-26-17-19-27(20-18-26)36-21-23-37(24-22-36)33(39)30-25-31(40-2)28-14-12-13-15-29(28)35-30/h12-15,17-20,25H,3-11,16,21-24H2,1-2H3,(H,34,38)