tert-butyl (2R,5S)-5-(hydroxymethyl)-5-methyl-6-oxidanylidene-3-phenyl-2-propan-2-yl-2H-pyrazine-1-carboxylate

Systemtic Name: tert-butyl (2R,5S)-5-(hydroxymethyl)-5-methyl-6-oxidanylidene-3-phenyl-2-propan-2-yl-2H-pyrazine-1-carboxylate Openeye Name: tert-butyl (2R,5S)-5-(hydroxymethyl)-2-isopropyl-5-methyl-6-oxo-3-phenyl-2H-pyrazine-1-carboxylate CAS Name: (2R,5S)-5-(hydroxymethyl)-5-methyl-6-oxo-3-phenyl-2-propan-2-yl-2H-pyrazine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,5S)-5-(hydroxymethyl)-5-methyl-6-oxo-3-phenyl-2-propan-2-yl-2H-pyrazine-1-carboxylate Traditional Name: (2R,5S)-2-isopropyl-6-keto-5-methyl-5-methylol-3-phenyl-2H-pyrazine-1-carboxylic acid tert-butyl ester Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=NC(C(=O)N1C(=O)OC(C)(C)C)(C)CO)C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2O4/c1-13(2)16-15(14-10-8-7-9-11-14)21-20(6,12-23)17(24)22(16)18(25)26-19(3,4)5/h7-11,13,16,23H,12H2,1-6H3/t16-,20+/m1/s1