4-[2-(5-bromanylquinolin-8-yl)-1H-benzo[g]indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(5-bromanylquinolin-8-yl)-1H-benzo[g]indol-3-yl]butan-1-amine Openeye Name: 4-[2-(5-bromo-8-quinolyl)-1H-benzo[g]indol-3-yl]butan-1-amine CAS Name: 4-[2-(5-bromo-8-quinolinyl)-1H-benzo[g]indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(5-bromoquinolin-8-yl)-1H-benzo[g]indol-3-yl]butan-1-amine Traditional Name: 4-[2-(5-bromo-8-quinolyl)-1H-benz[g]indol-3-yl]butylamine Formula: C25H22BrN3 MolecularWeight: 444.36628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2NC(=C3CCCCN)C4=C5C(=C(C=C4)Br)C=CC=N5

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2NC(=C3CCCCN)C4=C5C(=C(C=C4)Br)C=CC=N5

InChI

InChI=1S/C25H22BrN3/c26-22-13-12-21(23-20(22)9-5-15-28-23)25-18(8-3-4-14-27)19-11-10-16-6-1-2-7-17(16)24(19)29-25/h1-2,5-7,9-13,15,29H,3-4,8,14,27H2