3-(4-azanylbutyl)-2-[2-(trifluoromethyl)phenyl]-1H-indole-5-carboxylic acid

Systemtic Name: 3-(4-azanylbutyl)-2-[2-(trifluoromethyl)phenyl]-1H-indole-5-carboxylic acid Openeye Name: 3-(4-aminobutyl)-2-[2-(trifluoromethyl)phenyl]-1H-indole-5-carboxylic acid CAS Name: 3-(4-aminobutyl)-2-[2-(trifluoromethyl)phenyl]-1H-indole-5-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-2-[2-(trifluoromethyl)phenyl]-1H-indole-5-carboxylic acid Traditional Name: 3-(4-aminobutyl)-2-[2-(trifluoromethyl)phenyl]-1H-indole-5-carboxylic acid Formula: C20H19F3N2O2 MolecularWeight: 376.37227

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CCCCN)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CCCCN)C(F)(F)F

InChI

InChI=1S/C20H19F3N2O2/c21-20(22,23)16-7-2-1-6-14(16)18-13(5-3-4-10-24)15-11-12(19(26)27)8-9-17(15)25-18/h1-2,6-9,11,25H,3-5,10,24H2,(H,26,27)