[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 3-fluoranyl-4-methoxy-benzoate

Systemtic Name: [2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 3-fluoranyl-4-methoxy-benzoate Openeye Name: [2-(cyclohexylmethylamino)-2-oxo-ethyl] 3-fluoro-4-methoxy-benzoate CAS Name: 3-fluoro-4-methoxybenzoic acid [2-(cyclohexylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylmethylamino)-2-oxoethyl] 3-fluoro-4-methoxybenzoate Traditional Name: 3-fluoro-4-methoxy-benzoic acid [2-(cyclohexylmethylamino)-2-keto-ethyl] ester Formula: C17H22FNO4 MolecularWeight: 323.359283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)NCC2CCCCC2)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)NCC2CCCCC2)F

InChI

InChI=1S/C17H22FNO4/c1-22-15-8-7-13(9-14(15)18)17(21)23-11-16(20)19-10-12-5-3-2-4-6-12/h7-9,12H,2-6,10-11H2,1H3,(H,19,20)