ethyl (1S,9aR)-1-ethenyl-9-oxidanylidene-2,3,5,6,7,8-hexahydro-1H-pyrrolo[1,2-a]azepine-9a-carboxylate

Systemtic Name: ethyl (1S,9aR)-1-ethenyl-9-oxidanylidene-2,3,5,6,7,8-hexahydro-1H-pyrrolo[1,2-a]azepine-9a-carboxylate Openeye Name: ethyl (1S,9aR)-9-oxo-1-vinyl-2,3,5,6,7,8-hexahydro-1H-pyrrolo[1,2-a]azepine-9a-carboxylate CAS Name: (1S,9aR)-1-ethenyl-9-oxo-2,3,5,6,7,8-hexahydro-1H-pyrrolo[1,2-a]azepine-9a-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,9aR)-1-ethenyl-9-oxo-2,3,5,6,7,8-hexahydro-1H-pyrrolo[1,2-a]azepine-9a-carboxylate Traditional Name: (1S,9aR)-9-keto-1-vinyl-2,3,5,6,7,8-hexahydro-1H-pyrrol[1,2-a]azepine-9a-carboxylic acid ethyl ester Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C12C(CCN1CCCCC2=O)C=C

Isomeric SMILES

CCOC(=O)[C@]12[C@@H](CCN1CCCCC2=O)C=C

InChI

InChI=1S/C14H21NO3/c1-3-11-8-10-15-9-6-5-7-12(16)14(11,15)13(17)18-4-2/h3,11H,1,4-10H2,2H3/t11-,14-/m1/s1