(2-benzamido-2-oxidanylidene-ethyl) 2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (2-benzamido-2-oxo-ethyl) 2-[(2-fluorobenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(2-fluorophenyl)-oxomethyl]amino]-3-methylbutanoic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 2-[(2-fluorobenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(2-fluorobenzoyl)amino]-3-methyl-butyric acid (2-benzamido-2-keto-ethyl) ester Formula: C21H21FN2O5 MolecularWeight: 400.400243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC(=O)C1=CC=CC=C1)NC(=O)C2=CC=CC=C2F

Isomeric SMILES

CC(C)C(C(=O)OCC(=O)NC(=O)C1=CC=CC=C1)NC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C21H21FN2O5/c1-13(2)18(24-20(27)15-10-6-7-11-16(15)22)21(28)29-12-17(25)23-19(26)14-8-4-3-5-9-14/h3-11,13,18H,12H2,1-2H3,(H,24,27)(H,23,25,26)