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

Systemtic Name: [(R)-[(2R,4S)-2-tert-butyl-1-methyl-5-oxidanylidene-imidazolidin-4-yl]-(4-phenylphenyl)methyl] benzoate Openeye Name: [(R)-[(2R,4S)-2-tert-butyl-1-methyl-5-oxo-imidazolidin-4-yl]-(4-phenylphenyl)methyl] benzoate CAS Name: benzoic acid [(R)-[(2R,4S)-2-tert-butyl-1-methyl-5-oxo-4-imidazolidinyl]-(4-phenylphenyl)methyl] ester IUPAC Name: [(R)-[(2R,4S)-2-tert-butyl-1-methyl-5-oxoimidazolidin-4-yl]-(4-phenylphenyl)methyl] benzoate Traditional Name: benzoic acid [(R)-[(2R,4S)-2-tert-butyl-5-keto-1-methyl-imidazolidin-4-yl]-(4-phenylphenyl)methyl] ester Formula: C28H30N2O3 MolecularWeight: 442.5494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1NC(C(=O)N1C)C(C2=CC=C(C=C2)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)[C@@H]1N[C@H](C(=O)N1C)[C@@H](C2=CC=C(C=C2)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H30N2O3/c1-28(2,3)27-29-23(25(31)30(27)4)24(33-26(32)22-13-9-6-10-14-22)21-17-15-20(16-18-21)19-11-7-5-8-12-19/h5-18,23-24,27,29H,1-4H3/t23-,24+,27+/m0/s1