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

Systemtic Name: 4-[2-(5-bromanylquinolin-8-yl)-5-phenoxy-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(5-bromo-8-quinolyl)-5-phenoxy-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(5-bromo-8-quinolinyl)-5-phenoxy-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(5-bromoquinolin-8-yl)-5-phenoxy-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(5-bromo-8-quinolyl)-5-phenoxy-1H-indol-3-yl]butylamine Formula: C27H24BrN3O MolecularWeight: 486.40296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC3=C(C=C2)NC(=C3CCCCN)C4=C5C(=C(C=C4)Br)C=CC=N5

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC3=C(C=C2)NC(=C3CCCCN)C4=C5C(=C(C=C4)Br)C=CC=N5

InChI

InChI=1S/C27H24BrN3O/c28-24-13-12-22(26-21(24)10-6-16-30-26)27-20(9-4-5-15-29)23-17-19(11-14-25(23)31-27)32-18-7-2-1-3-8-18/h1-3,6-8,10-14,16-17,31H,4-5,9,15,29H2