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

Systemtic Name: 4-[4-chloranyl-2-(4-methoxyquinolin-2-yl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[4-chloro-2-(4-methoxy-2-quinolyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[4-chloro-2-(4-methoxy-2-quinolinyl)-7-(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[4-chloro-2-(4-methoxyquinolin-2-yl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[4-chloro-2-(4-methoxy-2-quinolyl)-7-(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C23H21ClF3N3O MolecularWeight: 447.88055

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21ClF3N3O/c1-31-19-12-18(29-17-8-3-2-6-13(17)19)21-14(7-4-5-11-28)20-16(24)10-9-15(22(20)30-21)23(25,26)27/h2-3,6,8-10,12,30H,4-5,7,11,28H2,1H3