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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NC(=O)CCCN)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NC(=O)CCCN)F

InChI

InChI=1S/C11H13FN2O3/c12-8-4-3-7(11(16)17)6-9(8)14-10(15)2-1-5-13/h3-4,6H,1-2,5,13H2,(H,14,15)(H,16,17)