tert-butyl (1S,5R)-6-[4-[(5S)-5-(acetamidomethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]phenyl]-6-cyano-3-azabicyclo[3.1.0]hexane-3-carboxylate

Systemtic Name: tert-butyl (1S,5R)-6-[4-[(5S)-5-(acetamidomethyl)-2-oxidanylidene-1,3-oxazolidin-3-yl]phenyl]-6-cyano-3-azabicyclo[3.1.0]hexane-3-carboxylate Openeye Name: tert-butyl (1S,5R)-6-[4-[(5S)-5-(acetamidomethyl)-2-oxo-oxazolidin-3-yl]phenyl]-6-cyano-3-azabicyclo[3.1.0]hexane-3-carboxylate CAS Name: (1S,5R)-6-[4-[(5S)-5-(acetamidomethyl)-2-oxo-3-oxazolidinyl]phenyl]-6-cyano-3-azabicyclo[3.1.0]hexane-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1S,5R)-6-[4-[(5S)-5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]-6-cyano-3-azabicyclo[3.1.0]hexane-3-carboxylate Traditional Name: (1S,5R)-6-[4-[(5S)-5-(acetamidomethyl)-2-keto-oxazolidin-3-yl]phenyl]-6-cyano-3-azabicyclo[3.1.0]hexane-3-carboxylic acid tert-butyl ester Formula: C23H28N4O5 MolecularWeight: 440.49222

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1CN(C(=O)O1)C2=CC=C(C=C2)C3(C4C3CN(C4)C(=O)OC(C)(C)C)C#N

Isomeric SMILES

CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC=C(C=C2)C3([C@H]4[C@@H]3CN(C4)C(=O)OC(C)(C)C)C#N

InChI

InChI=1S/C23H28N4O5/c1-14(28)25-9-17-10-27(21(30)31-17)16-7-5-15(6-8-16)23(13-24)18-11-26(12-19(18)23)20(29)32-22(2,3)4/h5-8,17-19H,9-12H2,1-4H3,(H,25,28)/t17-,18-,19+,23?/m0/s1