[(R)-[(2R,4S)-2-tert-butyl-1-methyl-5-oxidanylidene-imidazolidin-4-yl]-phenyl-methyl] benzoate

Systemtic Name: [(R)-[(2R,4S)-2-tert-butyl-1-methyl-5-oxidanylidene-imidazolidin-4-yl]-phenyl-methyl] benzoate Openeye Name: [(R)-[(2R,4S)-2-tert-butyl-1-methyl-5-oxo-imidazolidin-4-yl]-phenyl-methyl] benzoate CAS Name: benzoic acid [(R)-[(2R,4S)-2-tert-butyl-1-methyl-5-oxo-4-imidazolidinyl]-phenylmethyl] ester IUPAC Name: [(R)-[(2R,4S)-2-tert-butyl-1-methyl-5-oxoimidazolidin-4-yl]-phenylmethyl] benzoate Traditional Name: benzoic acid [(R)-[(2R,4S)-2-tert-butyl-5-keto-1-methyl-imidazolidin-4-yl]-phenyl-methyl] ester Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1NC(C(=O)N1C)C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)[C@@H]1N[C@H](C(=O)N1C)[C@@H](C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3/c1-22(2,3)21-23-17(19(25)24(21)4)18(15-11-7-5-8-12-15)27-20(26)16-13-9-6-10-14-16/h5-14,17-18,21,23H,1-4H3/t17-,18+,21+/m0/s1