4-[[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]amino]butanoic acid

Systemtic Name: 4-[[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]amino]butanoic acid Openeye Name: 4-[[2-(4-fluoroanilino)-2-oxo-ethyl]amino]butanoic acid CAS Name: 4-[[2-(4-fluoroanilino)-2-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-(4-fluoroanilino)-2-oxoethyl]amino]butanoic acid Traditional Name: 4-[[2-(4-fluoroanilino)-2-keto-ethyl]amino]butyric acid Formula: C12H15FN2O3 MolecularWeight: 254.257503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CNCCCC(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CNCCCC(=O)O)F

InChI

InChI=1S/C12H15FN2O3/c13-9-3-5-10(6-4-9)15-11(16)8-14-7-1-2-12(17)18/h3-6,14H,1-2,7-8H2,(H,15,16)(H,17,18)