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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C3=C(C4=C(C=CC(=C4N3)Cl)Cl)CCCCN

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C3=C(C4=C(C=CC(=C4N3)Cl)Cl)CCCCN

InChI

InChI=1S/C22H21Cl2N3O/c1-28-19-12-18(26-17-8-3-2-6-13(17)19)21-14(7-4-5-11-25)20-15(23)9-10-16(24)22(20)27-21/h2-3,6,8-10,12,27H,4-5,7,11,25H2,1H3