[1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 3-[(4-fluorophenyl)methoxy]benzoate

Systemtic Name: [1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 3-[(4-fluorophenyl)methoxy]benzoate Openeye Name: [2-(isobutylamino)-1-methyl-2-oxo-ethyl] 3-[(4-fluorophenyl)methoxy]benzoate CAS Name: 3-[(4-fluorophenyl)methoxy]benzoic acid [1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylpropylamino)-1-oxopropan-2-yl] 3-[(4-fluorophenyl)methoxy]benzoate Traditional Name: 3-(4-fluorobenzyl)oxybenzoic acid [2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H24FNO4 MolecularWeight: 373.417963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)C1=CC(=CC=C1)OCC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)CNC(=O)C(C)OC(=O)C1=CC(=CC=C1)OCC2=CC=C(C=C2)F

InChI

InChI=1S/C21H24FNO4/c1-14(2)12-23-20(24)15(3)27-21(25)17-5-4-6-19(11-17)26-13-16-7-9-18(22)10-8-16/h4-11,14-15H,12-13H2,1-3H3,(H,23,24)