tert-butyl (3aR,7aR)-4-oxidanylidene-3,3a,5,6,7,7a-hexahydro-2H-indole-1-carboxylate

Systemtic Name: tert-butyl (3aR,7aR)-4-oxidanylidene-3,3a,5,6,7,7a-hexahydro-2H-indole-1-carboxylate Openeye Name: tert-butyl (3aR,7aR)-4-oxo-3,3a,5,6,7,7a-hexahydro-2H-indole-1-carboxylate CAS Name: (3aR,7aR)-4-oxo-3,3a,5,6,7,7a-hexahydro-2H-indole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3aR,7aR)-4-oxo-3,3a,5,6,7,7a-hexahydro-2H-indole-1-carboxylate Traditional Name: (3aR,7aR)-4-keto-3,3a,5,6,7,7a-hexahydro-2H-indole-1-carboxylic acid tert-butyl ester Formula: C13H21NO3 MolecularWeight: 239.31074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2C1CCCC2=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCC2=O

InChI

InChI=1S/C13H21NO3/c1-13(2,3)17-12(16)14-8-7-9-10(14)5-4-6-11(9)15/h9-10H,4-8H2,1-3H3/t9-,10-/m1/s1