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

Systemtic Name: 4-[2-(4-tert-butylphenyl)-5-chloranyl-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(4-tert-butylphenyl)-5-chloro-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(4-tert-butylphenyl)-5-chloro-7-(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(4-tert-butylphenyl)-5-chloro-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(4-tert-butylphenyl)-5-chloro-7-(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C23H26ClF3N2 MolecularWeight: 422.91415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(C3=CC(=CC(=C3N2)C(F)(F)F)Cl)CCCCN

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C3=CC(=CC(=C3N2)C(F)(F)F)Cl)CCCCN

InChI

InChI=1S/C23H26ClF3N2/c1-22(2,3)15-9-7-14(8-10-15)20-17(6-4-5-11-28)18-12-16(24)13-19(21(18)29-20)23(25,26)27/h7-10,12-13,29H,4-6,11,28H2,1-3H3