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

Systemtic Name: 3-(3-azanylpropanoylamino)-4-fluoranyl-benzoic acid Openeye Name: 3-(3-aminopropanoylamino)-4-fluoro-benzoic acid CAS Name: 3-[(3-amino-1-oxopropyl)amino]-4-fluorobenzoic acid IUPAC Name: 3-(3-aminopropanoylamino)-4-fluorobenzoic acid Traditional Name: 3-(3-aminopropanoylamino)-4-fluoro-benzoic acid Formula: C10H11FN2O3 MolecularWeight: 226.204343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11FN2O3/c11-7-2-1-6(10(15)16)5-8(7)13-9(14)3-4-12/h1-2,5H,3-4,12H2,(H,13,14)(H,15,16)