4-[2-(5-bromanylquinolin-8-yl)-5,7-bis(chloranyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(5-bromanylquinolin-8-yl)-5,7-bis(chloranyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(5-bromo-8-quinolyl)-5,7-dichloro-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(5-bromo-8-quinolinyl)-5,7-dichloro-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(5-bromoquinolin-8-yl)-5,7-dichloro-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(5-bromo-8-quinolyl)-5,7-dichloro-1H-indol-3-yl]butylamine Formula: C21H18BrCl2N3 MolecularWeight: 463.19772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)C3=C(C4=CC(=CC(=C4N3)Cl)Cl)CCCCN)Br

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)C3=C(C4=CC(=CC(=C4N3)Cl)Cl)CCCCN)Br

InChI

InChI=1S/C21H18BrCl2N3/c22-17-7-6-15(19-14(17)5-3-9-26-19)20-13(4-1-2-8-25)16-10-12(23)11-18(24)21(16)27-20/h3,5-7,9-11,27H,1-2,4,8,25H2