tert-butyl (2R)-2-[(3aS,7aS)-2-oxidanylidene-3,3a,4,7-tetrahydro-1-benzofuran-7a-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl (2R)-2-[(3aS,7aS)-2-oxidanylidene-3,3a,4,7-tetrahydro-1-benzofuran-7a-yl]piperidine-1-carboxylate Openeye Name: tert-butyl (2R)-2-[(3aS,7aS)-2-oxo-3,3a,4,7-tetrahydrobenzofuran-7a-yl]piperidine-1-carboxylate CAS Name: (2R)-2-[(3aS,7aS)-2-oxo-3,3a,4,7-tetrahydrobenzofuran-7a-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[(3aS,7aS)-2-oxo-3,3a,4,7-tetrahydro-1-benzofuran-7a-yl]piperidine-1-carboxylate Traditional Name: (2R)-2-[(3aS,7aS)-2-keto-3,3a,4,7-tetrahydrobenzofuran-7a-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC1C23CC=CCC2CC(=O)O3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@]23CC=CC[C@H]2CC(=O)O3

InChI

InChI=1S/C18H27NO4/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/h4,6,13-14H,5,7-12H2,1-3H3/t13-,14+,18-/m0/s1