(phenylmethyl) 1-[5-benzamido-3,3-bis(fluoranyl)-4-oxidanylidene-6-phenyl-hexanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) 1-[5-benzamido-3,3-bis(fluoranyl)-4-oxidanylidene-6-phenyl-hexanoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl 1-(5-benzamido-3,3-difluoro-4-oxo-6-phenyl-hexanoyl)pyrrolidine-2-carboxylate CAS Name: 1-(5-benzamido-3,3-difluoro-1,4-dioxo-6-phenylhexyl)-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-(5-benzamido-3,3-difluoro-4-oxo-6-phenylhexanoyl)pyrrolidine-2-carboxylate Traditional Name: 1-(5-benzamido-3,3-difluoro-4-keto-6-phenyl-hexanoyl)pyrrolidine-2-carboxylic acid benzyl ester Formula: C31H30F2N2O5 MolecularWeight: 548.577106

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC(C(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)(F)F)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CC(N(C1)C(=O)CC(C(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)(F)F)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C31H30F2N2O5/c32-31(33,20-27(36)35-18-10-17-26(35)30(39)40-21-23-13-6-2-7-14-23)28(37)25(19-22-11-4-1-5-12-22)34-29(38)24-15-8-3-9-16-24/h1-9,11-16,25-26H,10,17-21H2,(H,34,38)