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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)NC(=C2CCCCN)C3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

CCCCC1=CC2=C(C=C1)NC(=C2CCCCN)C3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C23H26ClF3N2/c1-2-3-6-15-8-11-21-18(13-15)17(7-4-5-12-28)22(29-21)19-14-16(23(25,26)27)9-10-20(19)24/h8-11,13-14,29H,2-7,12,28H2,1H3