tert-butyl (2S,4S)-2,4-dimethyl-5-oxidanylidene-1-[(E)-(phenylmethylidene)amino]pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl (2S,4S)-2,4-dimethyl-5-oxidanylidene-1-[(E)-(phenylmethylidene)amino]pyrrolidine-2-carboxylate Openeye Name: tert-butyl (2S,4S)-1-[(E)-benzylideneamino]-2,4-dimethyl-5-oxo-pyrrolidine-2-carboxylate CAS Name: (2S,4S)-2,4-dimethyl-5-oxo-1-[(E)-(phenylmethylene)amino]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4S)-1-[(E)-benzylideneamino]-2,4-dimethyl-5-oxopyrrolidine-2-carboxylate Traditional Name: (2S,4S)-1-[(E)-benzalamino]-5-keto-2,4-dimethyl-pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C18H24N2O3 MolecularWeight: 316.39476

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(C1=O)N=CC2=CC=CC=C2)(C)C(=O)OC(C)(C)C

Isomeric SMILES

C[C@H]1C[C@@](N(C1=O)/N=C/C2=CC=CC=C2)(C)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H24N2O3/c1-13-11-18(5,16(22)23-17(2,3)4)20(15(13)21)19-12-14-9-7-6-8-10-14/h6-10,12-13H,11H2,1-5H3/b19-12+/t13-,18-/m0/s1