bis(phenylmethyl) (2S)-2-[5-(2-oxidanylidene-4-phenyl-azetidin-1-yl)pentanoylamino]butanedioate

Systemtic Name: bis(phenylmethyl) (2S)-2-[5-(2-oxidanylidene-4-phenyl-azetidin-1-yl)pentanoylamino]butanedioate Openeye Name: dibenzyl (2S)-2-[5-(2-oxo-4-phenyl-azetidin-1-yl)pentanoylamino]butanedioate CAS Name: (2S)-2-[[1-oxo-5-(2-oxo-4-phenyl-1-azetidinyl)pentyl]amino]butanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl (2S)-2-[5-(2-oxo-4-phenylazetidin-1-yl)pentanoylamino]butanedioate Traditional Name: (2S)-2-[5-(2-keto-4-phenyl-azetidin-1-yl)pentanoylamino]succinic acid dibenzyl ester Formula: C32H34N2O6 MolecularWeight: 542.62216

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C1=O)CCCCC(=O)NC(CC(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C(N(C1=O)CCCCC(=O)N[C@@H](CC(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C32H34N2O6/c35-29(18-10-11-19-34-28(21-30(34)36)26-16-8-3-9-17-26)33-27(32(38)40-23-25-14-6-2-7-15-25)20-31(37)39-22-24-12-4-1-5-13-24/h1-9,12-17,27-28H,10-11,18-23H2,(H,33,35)/t27-,28?/m0/s1