[1-oxidanylidene-1-(1-phenylbutylamino)propan-2-yl] 3,5-bis(fluoranyl)benzoate

Systemtic Name: [1-oxidanylidene-1-(1-phenylbutylamino)propan-2-yl] 3,5-bis(fluoranyl)benzoate Openeye Name: [1-methyl-2-oxo-2-(1-phenylbutylamino)ethyl] 3,5-difluorobenzoate CAS Name: 3,5-difluorobenzoic acid [1-oxo-1-(1-phenylbutylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1-phenylbutylamino)propan-2-yl] 3,5-difluorobenzoate Traditional Name: 3,5-difluorobenzoic acid [2-keto-1-methyl-2-(1-phenylbutylamino)ethyl] ester Formula: C20H21F2NO3 MolecularWeight: 361.382446

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=CC(=CC(=C2)F)F

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=CC(=CC(=C2)F)F

InChI

InChI=1S/C20H21F2NO3/c1-3-7-18(14-8-5-4-6-9-14)23-19(24)13(2)26-20(25)15-10-16(21)12-17(22)11-15/h4-6,8-13,18H,3,7H2,1-2H3,(H,23,24)