(2S)-2-(1-adamantyl)-2-[2-(4-fluoranylphenoxy)ethanoylamino]ethanoate

Systemtic Name: (2S)-2-(1-adamantyl)-2-[2-(4-fluoranylphenoxy)ethanoylamino]ethanoate Openeye Name: (2S)-2-(1-adamantyl)-2-[[2-(4-fluorophenoxy)acetyl]amino]acetate CAS Name: (2S)-2-(1-adamantyl)-2-[[2-(4-fluorophenoxy)-1-oxoethyl]amino]acetate IUPAC Name: (2S)-2-(1-adamantyl)-2-[[2-(4-fluorophenoxy)acetyl]amino]acetate Traditional Name: (2S)-2-(1-adamantyl)-2-[[2-(4-fluorophenoxy)acetyl]amino]acetate Formula: C20H23FNO4- MolecularWeight: 360.399323

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(C(=O)[O-])NC(=O)COC4=CC=C(C=C4)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[C@@H](C(=O)[O-])NC(=O)COC4=CC=C(C=C4)F

InChI

InChI=1S/C20H24FNO4/c21-15-1-3-16(4-2-15)26-11-17(23)22-18(19(24)25)20-8-12-5-13(9-20)7-14(6-12)10-20/h1-4,12-14,18H,5-11H2,(H,22,23)(H,24,25)/p-1/t12?,13?,14?,18-,20?/m1/s1