[(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-fluoranyl-4-methoxy-benzoate

Systemtic Name: [(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-fluoranyl-4-methoxy-benzoate Openeye Name: [(1R)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 2-fluoro-4-methoxy-benzoate CAS Name: 2-fluoro-4-methoxybenzoic acid [(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl] 2-fluoro-4-methoxybenzoate Traditional Name: 2-fluoro-4-methoxy-benzoic acid [(1R)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H22FNO4 MolecularWeight: 323.359283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)OC(=O)C2=C(C=C(C=C2)OC)F

Isomeric SMILES

C[C@H](C(=O)NC1CCCCC1)OC(=O)C2=C(C=C(C=C2)OC)F

InChI

InChI=1S/C17H22FNO4/c1-11(16(20)19-12-6-4-3-5-7-12)23-17(21)14-9-8-13(22-2)10-15(14)18/h8-12H,3-7H2,1-2H3,(H,19,20)/t11-/m1/s1