2-[[4-[[(3-fluorophenyl)-pyrazin-2-yl-carbamoyl]oxymethyl]cyclohexyl]methoxy]ethanoic acid

Systemtic Name: 2-[[4-[[(3-fluorophenyl)-pyrazin-2-yl-carbamoyl]oxymethyl]cyclohexyl]methoxy]ethanoic acid Openeye Name: 2-[[4-[[(3-fluorophenyl)-pyrazin-2-yl-carbamoyl]oxymethyl]cyclohexyl]methoxy]acetic acid CAS Name: 2-[[4-[[[3-fluoro-N-(2-pyrazinyl)anilino]-oxomethoxy]methyl]cyclohexyl]methoxy]acetic acid IUPAC Name: 2-[[4-[[(3-fluorophenyl)-pyrazin-2-ylcarbamoyl]oxymethyl]cyclohexyl]methoxy]acetic acid Traditional Name: 2-[[4-[[(3-fluorophenyl)-pyrazin-2-yl-carbamoyl]oxymethyl]cyclohexyl]methoxy]acetic acid Formula: C21H24FN3O5 MolecularWeight: 417.430763

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1COCC(=O)O)COC(=O)N(C2=CC(=CC=C2)F)C3=NC=CN=C3

Isomeric SMILES

C1CC(CCC1COCC(=O)O)COC(=O)N(C2=CC(=CC=C2)F)C3=NC=CN=C3

InChI

InChI=1S/C21H24FN3O5/c22-17-2-1-3-18(10-17)25(19-11-23-8-9-24-19)21(28)30-13-16-6-4-15(5-7-16)12-29-14-20(26)27/h1-3,8-11,15-16H,4-7,12-14H2,(H,26,27)