4-[2-(5-bromanyl-2-chloranyl-phenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(5-bromanyl-2-chloranyl-phenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(5-bromo-2-chloro-phenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(5-bromo-2-chlorophenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(5-bromo-2-chlorophenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(5-bromo-2-chloro-phenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C20H16BrClF6N2 MolecularWeight: 513.701859

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C2=C(C3=C(C=C(C=C3N2)C(F)(F)F)C(F)(F)F)CCCCN)Cl

Isomeric SMILES

C1=CC(=C(C=C1Br)C2=C(C3=C(C=C(C=C3N2)C(F)(F)F)C(F)(F)F)CCCCN)Cl

InChI

InChI=1S/C20H16BrClF6N2/c21-11-4-5-15(22)13(9-11)18-12(3-1-2-6-29)17-14(20(26,27)28)7-10(19(23,24)25)8-16(17)30-18/h4-5,7-9,30H,1-3,6,29H2