3,3-bis(fluoranyl)-2-[methanoyl(phenylmethoxycarbonyl)amino]-2-methyl-4-oxidanylidene-6-phenyl-hexanoic acid

Systemtic Name: 3,3-bis(fluoranyl)-2-[methanoyl(phenylmethoxycarbonyl)amino]-2-methyl-4-oxidanylidene-6-phenyl-hexanoic acid Openeye Name: 2-[benzyloxycarbonyl(formyl)amino]-3,3-difluoro-2-methyl-4-oxo-6-phenyl-hexanoic acid CAS Name: 3,3-difluoro-2-[formyl(phenylmethoxycarbonyl)amino]-2-methyl-4-oxo-6-phenylhexanoic acid IUPAC Name: 3,3-difluoro-2-[formyl(phenylmethoxycarbonyl)amino]-2-methyl-4-oxo-6-phenylhexanoic acid Traditional Name: 2-[carbobenzoxy(formyl)amino]-3,3-difluoro-4-keto-2-methyl-6-phenyl-hexanoic acid Formula: C22H21F2NO6 MolecularWeight: 433.402046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)(C(C(=O)CCC1=CC=CC=C1)(F)F)N(C=O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)O)(C(C(=O)CCC1=CC=CC=C1)(F)F)N(C=O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H21F2NO6/c1-21(19(28)29,22(23,24)18(27)13-12-16-8-4-2-5-9-16)25(15-26)20(30)31-14-17-10-6-3-7-11-17/h2-11,15H,12-14H2,1H3,(H,28,29)