tert-butyl (2S,3S)-3-(methoxymethoxy)-2-[2-oxidanyl-3-(4-oxidanylidenequinazolin-3-yl)propyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl (2S,3S)-3-(methoxymethoxy)-2-[2-oxidanyl-3-(4-oxidanylidenequinazolin-3-yl)propyl]piperidine-1-carboxylate Openeye Name: tert-butyl (2S,3S)-2-[2-hydroxy-3-(4-oxoquinazolin-3-yl)propyl]-3-(methoxymethoxy)piperidine-1-carboxylate CAS Name: (2S,3S)-2-[2-hydroxy-3-(4-oxo-3-quinazolinyl)propyl]-3-(methoxymethoxy)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3S)-2-[2-hydroxy-3-(4-oxoquinazolin-3-yl)propyl]-3-(methoxymethoxy)piperidine-1-carboxylate Traditional Name: (2S,3S)-2-[2-hydroxy-3-(4-ketoquinazolin-3-yl)propyl]-3-(methoxymethoxy)piperidine-1-carboxylic acid tert-butyl ester Formula: C23H33N3O6 MolecularWeight: 447.52462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1CC(CN2C=NC3=CC=CC=C3C2=O)O)OCOC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]1CC(CN2C=NC3=CC=CC=C3C2=O)O)OCOC

InChI

InChI=1S/C23H33N3O6/c1-23(2,3)32-22(29)26-11-7-10-20(31-15-30-4)19(26)12-16(27)13-25-14-24-18-9-6-5-8-17(18)21(25)28/h5-6,8-9,14,16,19-20,27H,7,10-13,15H2,1-4H3/t16?,19-,20-/m0/s1