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

Systemtic Name: 4-[2-[2-chloranyl-5-(trifluoromethyl)phenyl]-5-ethoxy-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-[2-chloro-5-(trifluoromethyl)phenyl]-5-ethoxy-1H-indol-3-yl]butan-1-amine CAS Name: 4-[2-[2-chloro-5-(trifluoromethyl)phenyl]-5-ethoxy-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[2-[2-chloro-5-(trifluoromethyl)phenyl]-5-ethoxy-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-[2-chloro-5-(trifluoromethyl)phenyl]-5-ethoxy-1H-indol-3-yl]butylamine Formula: C21H22ClF3N2O MolecularWeight: 410.86039

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=C2CCCCN)C3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=C2CCCCN)C3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C21H22ClF3N2O/c1-2-28-14-7-9-19-16(12-14)15(5-3-4-10-26)20(27-19)17-11-13(21(23,24)25)6-8-18(17)22/h6-9,11-12,27H,2-5,10,26H2,1H3