(2S)-2-[(3-fluorophenyl)methylamino]pentanedioic acid

Systemtic Name: (2S)-2-[(3-fluorophenyl)methylamino]pentanedioic acid Openeye Name: (2S)-2-[(3-fluorophenyl)methylamino]pentanedioic acid CAS Name: (2S)-2-[(3-fluorophenyl)methylamino]pentanedioic acid IUPAC Name: (2S)-2-[(3-fluorophenyl)methylamino]pentanedioic acid Traditional Name: (2S)-2-[(3-fluorobenzyl)amino]glutaric acid Formula: C12H14FNO4 MolecularWeight: 255.242263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CNC(CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)F)CN[C@@H](CCC(=O)O)C(=O)O

InChI

InChI=1S/C12H14FNO4/c13-9-3-1-2-8(6-9)7-14-10(12(17)18)4-5-11(15)16/h1-3,6,10,14H,4-5,7H2,(H,15,16)(H,17,18)/t10-/m0/s1