2-[2-ethylbutanoyl-(3-fluorophenyl)amino]ethanoic acid

Systemtic Name: 2-[2-ethylbutanoyl-(3-fluorophenyl)amino]ethanoic acid Openeye Name: 2-[N-(2-ethylbutanoyl)-3-fluoro-anilino]acetic acid CAS Name: 2-(N-(2-ethyl-1-oxobutyl)-3-fluoroanilino)acetic acid IUPAC Name: 2-[N-(2-ethylbutanoyl)-3-fluoroanilino]acetic acid Traditional Name: 2-[N-(2-ethylbutanoyl)-3-fluoro-anilino]acetic acid Formula: C14H18FNO3 MolecularWeight: 267.296023

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N(CC(=O)O)C1=CC(=CC=C1)F

Isomeric SMILES

CCC(CC)C(=O)N(CC(=O)O)C1=CC(=CC=C1)F

InChI

InChI=1S/C14H18FNO3/c1-3-10(4-2)14(19)16(9-13(17)18)12-7-5-6-11(15)8-12/h5-8,10H,3-4,9H2,1-2H3,(H,17,18)