6-azanyl-1-[2-(dibutylamino)quinolin-4-yl]hexan-1-one bromide

Systemtic Name: 6-azanyl-1-[2-(dibutylamino)quinolin-4-yl]hexan-1-one bromide Openeye Name: 6-amino-1-[2-(dibutylamino)-4-quinolyl]hexan-1-one bromide CAS Name: 6-amino-1-[2-(dibutylamino)-4-quinolinyl]-1-hexanone bromide IUPAC Name: 6-amino-1-[2-(dibutylamino)quinolin-4-yl]hexan-1-one bromide Traditional Name: 6-amino-1-[2-(dibutylamino)-4-quinolyl]hexan-1-one bromide Formula: C23H35BrN3O- MolecularWeight: 449.4475

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=NC2=CC=CC=C2C(=C1)C(=O)CCCCCN.[Br-]

Isomeric SMILES

CCCCN(CCCC)C1=NC2=CC=CC=C2C(=C1)C(=O)CCCCCN.[Br-]

InChI

InChI=1S/C23H35N3O.BrH/c1-3-5-16-26(17-6-4-2)23-18-20(22(27)14-8-7-11-15-24)19-12-9-10-13-21(19)25-23;/h9-10,12-13,18H,3-8,11,14-17,24H2,1-2H3;1H/p-1