methyl 3-[(4S,5S)-1,3-ditert-butyl-2-oxidanylidene-5-phenyl-imidazolidin-4-yl]propanoate

Systemtic Name: methyl 3-[(4S,5S)-1,3-ditert-butyl-2-oxidanylidene-5-phenyl-imidazolidin-4-yl]propanoate Openeye Name: methyl 3-[(4S,5S)-1,3-ditert-butyl-2-oxo-5-phenyl-imidazolidin-4-yl]propanoate CAS Name: 3-[(4S,5S)-1,3-ditert-butyl-2-oxo-5-phenyl-4-imidazolidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(4S,5S)-1,3-ditert-butyl-2-oxo-5-phenylimidazolidin-4-yl]propanoate Traditional Name: 3-[(4S,5S)-1,3-ditert-butyl-2-keto-5-phenyl-imidazolidin-4-yl]propionic acid methyl ester Formula: C21H32N2O3 MolecularWeight: 360.49038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(C(N(C1=O)C(C)(C)C)C2=CC=CC=C2)CCC(=O)OC

Isomeric SMILES

CC(C)(C)N1[C@H]([C@@H](N(C1=O)C(C)(C)C)C2=CC=CC=C2)CCC(=O)OC

InChI

InChI=1S/C21H32N2O3/c1-20(2,3)22-16(13-14-17(24)26-7)18(15-11-9-8-10-12-15)23(19(22)25)21(4,5)6/h8-12,16,18H,13-14H2,1-7H3/t16-,18-/m0/s1