4-[4-chloranyl-2-(2-methoxy-3-methyl-phenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[4-chloranyl-2-(2-methoxy-3-methyl-phenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[4-chloro-2-(2-methoxy-3-methyl-phenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[4-chloro-2-(2-methoxy-3-methylphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[4-chloro-2-(2-methoxy-3-methylphenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[4-chloro-2-(2-methoxy-3-methyl-phenyl)-7-(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C21H22ClF3N2O MolecularWeight: 410.86039

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C2=C(C3=C(C=CC(=C3N2)C(F)(F)F)Cl)CCCCN

Isomeric SMILES

CC1=CC=CC(=C1OC)C2=C(C3=C(C=CC(=C3N2)C(F)(F)F)Cl)CCCCN

InChI

InChI=1S/C21H22ClF3N2O/c1-12-6-5-8-14(20(12)28-2)18-13(7-3-4-11-26)17-16(22)10-9-15(19(17)27-18)21(23,24)25/h5-6,8-10,27H,3-4,7,11,26H2,1-2H3