ethanedioic acid; 3-[(2-fluorophenyl)methylamino]propanoic acid

Systemtic Name: ethanedioic acid; 3-[(2-fluorophenyl)methylamino]propanoic acid Openeye Name: 3-[(2-fluorophenyl)methylamino]propanoic acid; oxalic acid CAS Name: 3-[(2-fluorophenyl)methylamino]propanoic acid; oxalic acid IUPAC Name: 3-[(2-fluorophenyl)methylamino]propanoic acid; oxalic acid Traditional Name: 3-[(2-fluorobenzyl)amino]propionic acid; oxalic acid Formula: C12H14FNO6 MolecularWeight: 287.241063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNCCC(=O)O)F.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C(=C1)CNCCC(=O)O)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C10H12FNO2.C2H2O4/c11-9-4-2-1-3-8(9)7-12-6-5-10(13)14;3-1(4)2(5)6/h1-4,12H,5-7H2,(H,13,14);(H,3,4)(H,5,6)