3-[[butan-2-yl(ethyl)amino]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylic acid

Systemtic Name: 3-[[butan-2-yl(ethyl)amino]methyl]-4-fluoranyl-1-benzothiophene-2-carboxylic acid Openeye Name: 3-[[ethyl(sec-butyl)amino]methyl]-4-fluoro-benzothiophene-2-carboxylic acid CAS Name: 3-[[butan-2-yl(ethyl)amino]methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid IUPAC Name: 3-[[butan-2-yl(ethyl)amino]methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid Traditional Name: 3-[[ethyl(sec-butyl)amino]methyl]-4-fluoro-benzothiophene-2-carboxylic acid Formula: C16H20FNO2S MolecularWeight: 309.398903

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC)CC1=C(SC2=CC=CC(=C21)F)C(=O)O

Isomeric SMILES

CCC(C)N(CC)CC1=C(SC2=CC=CC(=C21)F)C(=O)O

InChI

InChI=1S/C16H20FNO2S/c1-4-10(3)18(5-2)9-11-14-12(17)7-6-8-13(14)21-15(11)16(19)20/h6-8,10H,4-5,9H2,1-3H3,(H,19,20)