ditert-butyl (2S,3S,5S)-7-oxidanylidene-2-phenyl-6-azaspiro[2.4]heptane-5,6-dicarboxylate

Systemtic Name: ditert-butyl (2S,3S,5S)-7-oxidanylidene-2-phenyl-6-azaspiro[2.4]heptane-5,6-dicarboxylate Openeye Name: ditert-butyl (2S,3S,5S)-7-oxo-2-phenyl-6-azaspiro[2.4]heptane-5,6-dicarboxylate CAS Name: (2S,3S,5S)-7-oxo-2-phenyl-6-azaspiro[2.4]heptane-5,6-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl (2S,3S,5S)-7-oxo-2-phenyl-6-azaspiro[2.4]heptane-5,6-dicarboxylate Traditional Name: (2S,3S,5S)-7-keto-2-phenyl-6-azaspiro[2.4]heptane-5,6-dicarboxylic acid ditert-butyl ester Formula: C22H29NO5 MolecularWeight: 387.46936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CC2(CC2C3=CC=CC=C3)C(=O)N1C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H]1C[C@]2(C[C@H]2C3=CC=CC=C3)C(=O)N1C(=O)OC(C)(C)C

InChI

InChI=1S/C22H29NO5/c1-20(2,3)27-17(24)16-13-22(12-15(22)14-10-8-7-9-11-14)18(25)23(16)19(26)28-21(4,5)6/h7-11,15-16H,12-13H2,1-6H3/t15-,16-,22-/m0/s1