tert-butyl (2R)-1-[2-[(1S)-2,2-dimethyl-1-oxidanyl-propyl]-4-oxidanylidene-quinazolin-3-yl]aziridine-2-carboxylate

Systemtic Name: tert-butyl (2R)-1-[2-[(1S)-2,2-dimethyl-1-oxidanyl-propyl]-4-oxidanylidene-quinazolin-3-yl]aziridine-2-carboxylate Openeye Name: tert-butyl (2R)-1-[2-[(1S)-1-hydroxy-2,2-dimethyl-propyl]-4-oxo-quinazolin-3-yl]aziridine-2-carboxylate CAS Name: (2R)-1-[2-[(1S)-1-hydroxy-2,2-dimethylpropyl]-4-oxo-3-quinazolinyl]-2-aziridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-1-[2-[(1S)-1-hydroxy-2,2-dimethylpropyl]-4-oxoquinazolin-3-yl]aziridine-2-carboxylate Traditional Name: (2R)-1-[2-[(1S)-1-hydroxy-2,2-dimethyl-propyl]-4-keto-quinazolin-3-yl]ethylenimine-2-carboxylic acid tert-butyl ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C1=NC2=CC=CC=C2C(=O)N1N3CC3C(=O)OC(C)(C)C)O

Isomeric SMILES

CC(C)(C)[C@@H](C1=NC2=CC=CC=C2C(=O)N1N3C[C@@H]3C(=O)OC(C)(C)C)O

InChI

InChI=1S/C20H27N3O4/c1-19(2,3)15(24)16-21-13-10-8-7-9-12(13)17(25)23(16)22-11-14(22)18(26)27-20(4,5)6/h7-10,14-15,24H,11H2,1-6H3/t14-,15-,22?/m1/s1