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

Systemtic Name: tert-butyl (2R,3S)-3-(methoxymethoxy)-2-[4-(4-oxidanylidenequinazolin-3-yl)butyl]piperidine-1-carboxylate Openeye Name: tert-butyl (2R,3S)-3-(methoxymethoxy)-2-[4-(4-oxoquinazolin-3-yl)butyl]piperidine-1-carboxylate CAS Name: (2R,3S)-3-(methoxymethoxy)-2-[4-(4-oxo-3-quinazolinyl)butyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,3S)-3-(methoxymethoxy)-2-[4-(4-oxoquinazolin-3-yl)butyl]piperidine-1-carboxylate Traditional Name: (2R,3S)-2-[4-(4-ketoquinazolin-3-yl)butyl]-3-(methoxymethoxy)piperidine-1-carboxylic acid tert-butyl ester Formula: C24H35N3O5 MolecularWeight: 445.5518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1CCCCN2C=NC3=CC=CC=C3C2=O)OCOC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]1CCCCN2C=NC3=CC=CC=C3C2=O)OCOC

InChI

InChI=1S/C24H35N3O5/c1-24(2,3)32-23(29)27-15-9-13-21(31-17-30-4)20(27)12-7-8-14-26-16-25-19-11-6-5-10-18(19)22(26)28/h5-6,10-11,16,20-21H,7-9,12-15,17H2,1-4H3/t20-,21+/m1/s1