3-[[2-[(3-fluoranyl-4-methyl-phenyl)methylamino]-2-oxidanylidene-ethyl]amino]propanoic acid

Systemtic Name: 3-[[2-[(3-fluoranyl-4-methyl-phenyl)methylamino]-2-oxidanylidene-ethyl]amino]propanoic acid Openeye Name: 3-[[2-[(3-fluoro-4-methyl-phenyl)methylamino]-2-oxo-ethyl]amino]propanoic acid CAS Name: 3-[[2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl]amino]propanoic acid Traditional Name: 3-[[2-[(3-fluoro-4-methyl-benzyl)amino]-2-keto-ethyl]amino]propionic acid Formula: C13H17FN2O3 MolecularWeight: 268.284083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)CNCCC(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)CNCCC(=O)O)F

InChI

InChI=1S/C13H17FN2O3/c1-9-2-3-10(6-11(9)14)7-16-12(17)8-15-5-4-13(18)19/h2-3,6,15H,4-5,7-8H2,1H3,(H,16,17)(H,18,19)