methyl (1S,4R,8S)-6-chloranyl-4-methoxy-1-methyl-3-oxidanylidene-2-oxa-5-azabicyclo[2.2.2]oct-5-ene-8-carboxylate

Systemtic Name: methyl (1S,4R,8S)-6-chloranyl-4-methoxy-1-methyl-3-oxidanylidene-2-oxa-5-azabicyclo[2.2.2]oct-5-ene-8-carboxylate Openeye Name: methyl (1S,4R,8S)-6-chloro-4-methoxy-1-methyl-3-oxo-2-oxa-5-azabicyclo[2.2.2]oct-5-ene-8-carboxylate CAS Name: (1S,4R,8S)-6-chloro-4-methoxy-1-methyl-3-oxo-2-oxa-5-azabicyclo[2.2.2]oct-5-ene-8-carboxylic acid methyl ester IUPAC Name: methyl (1S,4R,8S)-6-chloro-4-methoxy-1-methyl-3-oxo-2-oxa-5-azabicyclo[2.2.2]oct-5-ene-8-carboxylate Traditional Name: (1S,4R,8S)-6-chloro-3-keto-4-methoxy-1-methyl-2-oxa-5-azabicyclo[2.2.2]oct-5-ene-8-carboxylic acid methyl ester Formula: C10H12ClNO5 MolecularWeight: 261.65898

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC(C(C(=O)O1)(N=C2Cl)OC)C(=O)OC

Isomeric SMILES

C[C@@]12C[C@@H]([C@@](C(=O)O1)(N=C2Cl)OC)C(=O)OC

InChI

InChI=1S/C10H12ClNO5/c1-9-4-5(6(13)15-2)10(16-3,8(14)17-9)12-7(9)11/h5H,4H2,1-3H3/t5-,9+,10-/m1/s1