2-[5-acetamido-2-(4-fluorophenyl)-2-adamantyl]ethanoic acid

Systemtic Name: 2-[5-acetamido-2-(4-fluorophenyl)-2-adamantyl]ethanoic acid Openeye Name: 2-[5-acetamido-2-(4-fluorophenyl)-2-adamantyl]acetic acid CAS Name: 2-[5-acetamido-2-(4-fluorophenyl)-2-adamantyl]acetic acid IUPAC Name: 2-[5-acetamido-2-(4-fluorophenyl)-2-adamantyl]acetic acid Traditional Name: 2-[5-acetamido-2-(4-fluorophenyl)-2-adamantyl]acetic acid Formula: C20H24FNO3 MolecularWeight: 345.407863

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)C(C(C3)C2)(CC(=O)O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)NC12CC3CC(C1)C(C(C3)C2)(CC(=O)O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H24FNO3/c1-12(23)22-19-8-13-6-15(9-19)20(11-18(24)25,16(7-13)10-19)14-2-4-17(21)5-3-14/h2-5,13,15-16H,6-11H2,1H3,(H,22,23)(H,24,25)