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

Systemtic Name: 4-[2-[4-chloranyl-3-(trifluoromethyl)phenyl]-5,7-dimethyl-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-[4-chloro-3-(trifluoromethyl)phenyl]-5,7-dimethyl-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-[4-chloro-3-(trifluoromethyl)phenyl]-5,7-dimethyl-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-[4-chloro-3-(trifluoromethyl)phenyl]-5,7-dimethyl-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-[4-chloro-3-(trifluoromethyl)phenyl]-5,7-dimethyl-1H-indol-3-yl]butylamine Formula: C21H22ClF3N2 MolecularWeight: 394.86099

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(N2)C3=CC(=C(C=C3)Cl)C(F)(F)F)CCCCN)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(N2)C3=CC(=C(C=C3)Cl)C(F)(F)F)CCCCN)C

InChI

InChI=1S/C21H22ClF3N2/c1-12-9-13(2)19-16(10-12)15(5-3-4-8-26)20(27-19)14-6-7-18(22)17(11-14)21(23,24)25/h6-7,9-11,27H,3-5,8,26H2,1-2H3