3-(2-azanylbutanoylamino)-4-fluoranyl-benzoic acid

Systemtic Name: 3-(2-azanylbutanoylamino)-4-fluoranyl-benzoic acid Openeye Name: 3-(2-aminobutanoylamino)-4-fluoro-benzoic acid CAS Name: 3-[(2-amino-1-oxobutyl)amino]-4-fluorobenzoic acid IUPAC Name: 3-(2-aminobutanoylamino)-4-fluorobenzoic acid Traditional Name: 3-(2-aminobutanoylamino)-4-fluoro-benzoic acid Formula: C11H13FN2O3 MolecularWeight: 240.230923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13FN2O3/c1-2-8(13)10(15)14-9-5-6(11(16)17)3-4-7(9)12/h3-5,8H,2,13H2,1H3,(H,14,15)(H,16,17)