oxolane-2-carboxylic acid; (triphenylmethyl) (2S)-2-azanyl-2-(fluoranylmethyl)-3-(1H-imidazol-5-yl)propanoate

Systemtic Name: oxolane-2-carboxylic acid; (triphenylmethyl) (2S)-2-azanyl-2-(fluoranylmethyl)-3-(1H-imidazol-5-yl)propanoate Openeye Name: tetrahydrofuran-2-carboxylic acid; trityl (2S)-2-amino-2-(fluoromethyl)-3-(1H-imidazol-5-yl)propanoate CAS Name: (2S)-2-amino-2-(fluoromethyl)-3-(1H-imidazol-5-yl)propanoic acid (triphenylmethyl) ester; 2-oxolanecarboxylic acid IUPAC Name: oxolane-2-carboxylic acid; trityl (2S)-2-amino-2-(fluoromethyl)-3-(1H-imidazol-5-yl)propanoate Traditional Name: (2S)-2-amino-2-(fluoromethyl)-3-(1H-imidazol-5-yl)propionic acid trityl ester; tetrahydrofuran-2-carboxylic acid Formula: C31H32FN3O5 MolecularWeight: 545.601283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)O.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC(=O)C(CC4=CN=CN4)(CF)N

Isomeric SMILES

C1CC(OC1)C(=O)O.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC(=O)[C@@](CC4=CN=CN4)(CF)N

InChI

InChI=1S/C26H24FN3O2.C5H8O3/c27-18-25(28,16-23-17-29-19-30-23)24(31)32-26(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22;6-5(7)4-2-1-3-8-4/h1-15,17,19H,16,18,28H2,(H,29,30);4H,1-3H2,(H,6,7)/t25-;/m1./s1