2-(2-ethylbutanoylamino)-4-fluoranyl-benzoic acid

Systemtic Name: 2-(2-ethylbutanoylamino)-4-fluoranyl-benzoic acid Openeye Name: 2-(2-ethylbutanoylamino)-4-fluoro-benzoic acid CAS Name: 2-[(2-ethyl-1-oxobutyl)amino]-4-fluorobenzoic acid IUPAC Name: 2-(2-ethylbutanoylamino)-4-fluorobenzoic acid Traditional Name: 2-(2-ethylbutanoylamino)-4-fluoro-benzoic acid Formula: C13H16FNO3 MolecularWeight: 253.269443

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=C(C=CC(=C1)F)C(=O)O

Isomeric SMILES

CCC(CC)C(=O)NC1=C(C=CC(=C1)F)C(=O)O

InChI

InChI=1S/C13H16FNO3/c1-3-8(4-2)12(16)15-11-7-9(14)5-6-10(11)13(17)18/h5-8H,3-4H2,1-2H3,(H,15,16)(H,17,18)