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

Systemtic Name: tert-butyl (3aS,7aR)-2-oxidanylidene-3a,4,5,6,7,7a-hexahydro-3H-indole-1-carboxylate Openeye Name: tert-butyl (3aS,7aR)-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-indole-1-carboxylate CAS Name: (3aS,7aR)-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-indole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3aS,7aR)-2-oxo-3a,4,5,6,7,7a-hexahydro-3H-indole-1-carboxylate Traditional Name: (3aS,7aR)-2-keto-3a,4,5,6,7,7a-hexahydro-3H-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)N1C2CCCCC2CC1=O

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H]2CCCC[C@H]2CC1=O

InChI

InChI=1S/C13H21NO3/c1-13(2,3)17-12(16)14-10-7-5-4-6-9(10)8-11(14)15/h9-10H,4-8H2,1-3H3/t9-,10+/m0/s1