4-[4-chloranyl-2-(8-methoxyquinolin-5-yl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[4-chloranyl-2-(8-methoxyquinolin-5-yl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[4-chloro-2-(8-methoxy-5-quinolyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[4-chloro-2-(8-methoxy-5-quinolinyl)-7-(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[4-chloro-2-(8-methoxyquinolin-5-yl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[4-chloro-2-(8-methoxy-5-quinolyl)-7-(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C23H21ClF3N3O MolecularWeight: 447.88055

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3=C(C4=C(C=CC(=C4N3)C(F)(F)F)Cl)CCCCN)C=CC=N2

Isomeric SMILES

COC1=C2C(=C(C=C1)C3=C(C4=C(C=CC(=C4N3)C(F)(F)F)Cl)CCCCN)C=CC=N2

InChI

InChI=1S/C23H21ClF3N3O/c1-31-18-10-7-14(13-6-4-12-29-21(13)18)20-15(5-2-3-11-28)19-17(24)9-8-16(22(19)30-20)23(25,26)27/h4,6-10,12,30H,2-3,5,11,28H2,1H3