2-[1'-(2-adamantylcarbamoyl)-5-fluoranyl-spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]ethanoic acid

Systemtic Name: 2-[1'-(2-adamantylcarbamoyl)-5-fluoranyl-spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]ethanoic acid Openeye Name: 2-[1'-(2-adamantylcarbamoyl)-5-fluoro-spiro[indane-3,4'-piperidine]-1-yl]acetic acid CAS Name: 2-[1'-[(2-adamantylamino)-oxomethyl]-5-fluoro-1-spiro[1,2-dihydroindene-3,4'-piperidine]yl]acetic acid IUPAC Name: 2-[1'-(2-adamantylcarbamoyl)-5-fluorospiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetic acid Traditional Name: 2-[1'-(2-adamantylcarbamoyl)-5-fluoro-spiro[indane-3,4'-piperidine]-1-yl]acetic acid Formula: C26H33FN2O3 MolecularWeight: 440.550223

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12CC(C3=C2C=C(C=C3)F)CC(=O)O)C(=O)NC4C5CC6CC(C5)CC4C6

Isomeric SMILES

C1CN(CCC12CC(C3=C2C=C(C=C3)F)CC(=O)O)C(=O)NC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C26H33FN2O3/c27-20-1-2-21-19(12-23(30)31)14-26(22(21)13-20)3-5-29(6-4-26)25(32)28-24-17-8-15-7-16(10-17)11-18(24)9-15/h1-2,13,15-19,24H,3-12,14H2,(H,28,32)(H,30,31)