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

Systemtic Name: tert-butyl (2R,3S)-3-(methoxymethoxy)-2-[3-(4-oxidanylidenequinazolin-3-yl)propyl]piperidine-1-carboxylate Openeye Name: tert-butyl (2R,3S)-3-(methoxymethoxy)-2-[3-(4-oxoquinazolin-3-yl)propyl]piperidine-1-carboxylate CAS Name: (2R,3S)-3-(methoxymethoxy)-2-[3-(4-oxo-3-quinazolinyl)propyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3S)-3-(methoxymethoxy)-2-[3-(4-oxoquinazolin-3-yl)propyl]piperidine-1-carboxylate Traditional Name: (2R,3S)-2-[3-(4-ketoquinazolin-3-yl)propyl]-3-(methoxymethoxy)piperidine-1-carboxylic acid tert-butyl ester Formula: C23H33N3O5 MolecularWeight: 431.52522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1CCCN2C=NC3=CC=CC=C3C2=O)OCOC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]1CCCN2C=NC3=CC=CC=C3C2=O)OCOC

InChI

InChI=1S/C23H33N3O5/c1-23(2,3)31-22(28)26-14-8-12-20(30-16-29-4)19(26)11-7-13-25-15-24-18-10-6-5-9-17(18)21(25)27/h5-6,9-10,15,19-20H,7-8,11-14,16H2,1-4H3/t19-,20+/m1/s1