[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] (2R)-3-methyl-2-(phenylcarbamoylamino)butanoate

Systemtic Name: [2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] (2R)-3-methyl-2-(phenylcarbamoylamino)butanoate Openeye Name: [2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl] (2R)-3-methyl-2-(phenylcarbamoylamino)butanoate CAS Name: (2R)-2-[[anilino(oxo)methyl]amino]-3-methylbutanoic acid [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-fluorophenyl)methylamino]-2-oxoethyl] (2R)-3-methyl-2-(phenylcarbamoylamino)butanoate Traditional Name: (2R)-3-methyl-2-(phenylcarbamoylamino)butyric acid [2-[(4-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C21H24FN3O4 MolecularWeight: 401.431363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NCC1=CC=C(C=C1)F)NC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@H](C(=O)OCC(=O)NCC1=CC=C(C=C1)F)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H24FN3O4/c1-14(2)19(25-21(28)24-17-6-4-3-5-7-17)20(27)29-13-18(26)23-12-15-8-10-16(22)11-9-15/h3-11,14,19H,12-13H2,1-2H3,(H,23,26)(H2,24,25,28)/t19-/m1/s1