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

Systemtic Name: 3-(4-azanylbutyl)-2-[2,4-bis(fluoranyl)phenyl]-1H-indole-5-carboxylic acid Openeye Name: 3-(4-aminobutyl)-2-(2,4-difluorophenyl)-1H-indole-5-carboxylic acid CAS Name: 3-(4-aminobutyl)-2-(2,4-difluorophenyl)-1H-indole-5-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-2-(2,4-difluorophenyl)-1H-indole-5-carboxylic acid Traditional Name: 3-(4-aminobutyl)-2-(2,4-difluorophenyl)-1H-indole-5-carboxylic acid Formula: C19H18F2N2O2 MolecularWeight: 344.355226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)C(=C(N2)C3=C(C=C(C=C3)F)F)CCCCN

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)C(=C(N2)C3=C(C=C(C=C3)F)F)CCCCN

InChI

InChI=1S/C19H18F2N2O2/c20-12-5-6-14(16(21)10-12)18-13(3-1-2-8-22)15-9-11(19(24)25)4-7-17(15)23-18/h4-7,9-10,23H,1-3,8,22H2,(H,24,25)