4-[4,7-bis(chloranyl)-2-(6-methoxyquinolin-5-yl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[4,7-bis(chloranyl)-2-(6-methoxyquinolin-5-yl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[4,7-dichloro-2-(6-methoxy-5-quinolyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[4,7-dichloro-2-(6-methoxy-5-quinolinyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[4,7-dichloro-2-(6-methoxyquinolin-5-yl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[4,7-dichloro-2-(6-methoxy-5-quinolyl)-1H-indol-3-yl]butylamine Formula: C22H21Cl2N3O MolecularWeight: 414.32764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)N=CC=C2)C3=C(C4=C(C=CC(=C4N3)Cl)Cl)CCCCN

Isomeric SMILES

COC1=C(C2=C(C=C1)N=CC=C2)C3=C(C4=C(C=CC(=C4N3)Cl)Cl)CCCCN

InChI

InChI=1S/C22H21Cl2N3O/c1-28-18-10-9-17-13(6-4-12-26-17)20(18)21-14(5-2-3-11-25)19-15(23)7-8-16(24)22(19)27-21/h4,6-10,12,27H,2-3,5,11,25H2,1H3