(2S)-2-benzamido-6-[3-(fluoranylmethyl)-5-oxidanylidene-1,2,4-oxadiazol-4-yl]hexanoic acid

Systemtic Name: (2S)-2-benzamido-6-[3-(fluoranylmethyl)-5-oxidanylidene-1,2,4-oxadiazol-4-yl]hexanoic acid Openeye Name: (2S)-2-benzamido-6-[3-(fluoromethyl)-5-oxo-1,2,4-oxadiazol-4-yl]hexanoic acid CAS Name: (2S)-2-benzamido-6-[3-(fluoromethyl)-5-oxo-1,2,4-oxadiazol-4-yl]hexanoic acid IUPAC Name: (2S)-2-benzamido-6-[3-(fluoromethyl)-5-oxo-1,2,4-oxadiazol-4-yl]hexanoic acid Traditional Name: (2S)-2-benzamido-6-[3-(fluoromethyl)-5-keto-1,2,4-oxadiazol-4-yl]hexanoic acid Formula: C16H18FN3O5 MolecularWeight: 351.329623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CCCCN2C(=NOC2=O)CF)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N[C@@H](CCCCN2C(=NOC2=O)CF)C(=O)O

InChI

InChI=1S/C16H18FN3O5/c17-10-13-19-25-16(24)20(13)9-5-4-8-12(15(22)23)18-14(21)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,18,21)(H,22,23)/t12-/m0/s1