(2S)-2-[(4-fluorophenyl)carbamoylamino]pentanedioate

Systemtic Name: (2S)-2-[(4-fluorophenyl)carbamoylamino]pentanedioate Openeye Name: (2S)-2-[(4-fluorophenyl)carbamoylamino]pentanedioate CAS Name: (2S)-2-[[(4-fluoroanilino)-oxomethyl]amino]pentanedioate IUPAC Name: (2S)-2-[(4-fluorophenyl)carbamoylamino]pentanedioate Traditional Name: (2S)-2-[(4-fluorophenyl)carbamoylamino]glutarate Formula: C12H11FN2O5-2 MolecularWeight: 282.224543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)NC(CCC(=O)[O-])C(=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])F

InChI

InChI=1S/C12H13FN2O5/c13-7-1-3-8(4-2-7)14-12(20)15-9(11(18)19)5-6-10(16)17/h1-4,9H,5-6H2,(H,16,17)(H,18,19)(H2,14,15,20)/p-2/t9-/m0/s1