4-[5-tert-butyl-2-(4-methoxyquinolin-2-yl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[5-tert-butyl-2-(4-methoxyquinolin-2-yl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-tert-butyl-2-(4-methoxy-2-quinolyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-tert-butyl-2-(4-methoxy-2-quinolinyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-tert-butyl-2-(4-methoxyquinolin-2-yl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-tert-butyl-2-(4-methoxy-2-quinolyl)-1H-indol-3-yl]butylamine Formula: C26H31N3O MolecularWeight: 401.54384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)NC(=C2CCCCN)C3=NC4=CC=CC=C4C(=C3)OC

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)NC(=C2CCCCN)C3=NC4=CC=CC=C4C(=C3)OC

InChI

InChI=1S/C26H31N3O/c1-26(2,3)17-12-13-22-20(15-17)18(9-7-8-14-27)25(29-22)23-16-24(30-4)19-10-5-6-11-21(19)28-23/h5-6,10-13,15-16,29H,7-9,14,27H2,1-4H3