4-[2-(4-methylphenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(4-methylphenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(p-tolyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(4-methylphenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(4-methylphenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-(p-tolyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C21H20F6N2 MolecularWeight: 414.387319

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C3=C(C=C(C=C3N2)C(F)(F)F)C(F)(F)F)CCCCN

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C3=C(C=C(C=C3N2)C(F)(F)F)C(F)(F)F)CCCCN

InChI

InChI=1S/C21H20F6N2/c1-12-5-7-13(8-6-12)19-15(4-2-3-9-28)18-16(21(25,26)27)10-14(20(22,23)24)11-17(18)29-19/h5-8,10-11,29H,2-4,9,28H2,1H3