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

Systemtic Name: 4-[2-(4-ethoxyphenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(4-ethoxyphenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-(4-ethoxyphenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(4-ethoxyphenyl)-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-p-phenetyl-4,6-bis(trifluoromethyl)-1H-indol-3-yl]butylamine Formula: C22H22F6N2O MolecularWeight: 444.413299

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(C3=C(C=C(C=C3N2)C(F)(F)F)C(F)(F)F)CCCCN

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(C3=C(C=C(C=C3N2)C(F)(F)F)C(F)(F)F)CCCCN

InChI

InChI=1S/C22H22F6N2O/c1-2-31-15-8-6-13(7-9-15)20-16(5-3-4-10-29)19-17(22(26,27)28)11-14(21(23,24)25)12-18(19)30-20/h6-9,11-12,30H,2-5,10,29H2,1H3