tert-butyl (2R)-2-[(7aS)-2-oxidanylidene-4,7-dihydro-1-benzofuran-7a-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl (2R)-2-[(7aS)-2-oxidanylidene-4,7-dihydro-1-benzofuran-7a-yl]piperidine-1-carboxylate Openeye Name: tert-butyl (2R)-2-[(7aS)-2-oxo-4,7-dihydrobenzofuran-7a-yl]piperidine-1-carboxylate CAS Name: (2R)-2-[(7aS)-2-oxo-4,7-dihydrobenzofuran-7a-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[(7aS)-2-oxo-4,7-dihydro-1-benzofuran-7a-yl]piperidine-1-carboxylate Traditional Name: (2R)-2-[(7aS)-2-keto-4,7-dihydrobenzofuran-7a-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC1C23CC=CCC2=CC(=O)O3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@]23CC=CCC2=CC(=O)O3

InChI

InChI=1S/C18H25NO4/c1-17(2,3)23-16(21)19-11-7-5-9-14(19)18-10-6-4-8-13(18)12-15(20)22-18/h4,6,12,14H,5,7-11H2,1-3H3/t14-,18+/m1/s1