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

Systemtic Name: 4-[4-chloranyl-2-(2-methylquinolin-5-yl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[4-chloro-2-(2-methyl-5-quinolyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[4-chloro-2-(2-methyl-5-quinolinyl)-7-(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[4-chloro-2-(2-methylquinolin-5-yl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[4-chloro-2-(2-methyl-5-quinolyl)-7-(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C23H21ClF3N3 MolecularWeight: 431.88115

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC(=C2C=C1)C3=C(C4=C(C=CC(=C4N3)C(F)(F)F)Cl)CCCCN

Isomeric SMILES

CC1=NC2=CC=CC(=C2C=C1)C3=C(C4=C(C=CC(=C4N3)C(F)(F)F)Cl)CCCCN

InChI

InChI=1S/C23H21ClF3N3/c1-13-8-9-14-15(6-4-7-19(14)29-13)21-16(5-2-3-12-28)20-18(24)11-10-17(22(20)30-21)23(25,26)27/h4,6-11,30H,2-3,5,12,28H2,1H3