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

Systemtic Name: 4-[5-chloranyl-2-(3-phenoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-chloro-2-(3-phenoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-chloro-2-(3-phenoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-chloro-2-(3-phenoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-chloro-2-(3-phenoxyphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C25H22ClF3N2O MolecularWeight: 458.90319

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C3=C(C4=CC(=CC(=C4N3)C(F)(F)F)Cl)CCCCN

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)C3=C(C4=CC(=CC(=C4N3)C(F)(F)F)Cl)CCCCN

InChI

InChI=1S/C25H22ClF3N2O/c26-17-14-21-20(11-4-5-12-30)23(31-24(21)22(15-17)25(27,28)29)16-7-6-10-19(13-16)32-18-8-2-1-3-9-18/h1-3,6-10,13-15,31H,4-5,11-12,30H2