tert-butyl (4R)-4-(4,4-dicyano-1-oxidanylidene-1-phenyl-butan-2-yl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

Systemtic Name: tert-butyl (4R)-4-(4,4-dicyano-1-oxidanylidene-1-phenyl-butan-2-yl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate Openeye Name: tert-butyl (4R)-4-(1-benzoyl-3,3-dicyano-propyl)-2,2-dimethyl-oxazolidine-3-carboxylate CAS Name: (4R)-4-(4,4-dicyano-1-oxo-1-phenylbutan-2-yl)-2,2-dimethyl-3-oxazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4R)-4-(4,4-dicyano-1-oxo-1-phenylbutan-2-yl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate Traditional Name: (4R)-4-(1-benzoyl-3,3-dicyano-propyl)-2,2-dimethyl-oxazolidine-3-carboxylic acid tert-butyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N(C(CO1)C(CC(C#N)C#N)C(=O)C2=CC=CC=C2)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1(N([C@@H](CO1)C(CC(C#N)C#N)C(=O)C2=CC=CC=C2)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C22H27N3O4/c1-21(2,3)29-20(27)25-18(14-28-22(25,4)5)17(11-15(12-23)13-24)19(26)16-9-7-6-8-10-16/h6-10,15,17-18H,11,14H2,1-5H3/t17?,18-/m0/s1