methyl (1S,5R)-9-iodanyl-3-oxidanylidene-2-prop-2-enyl-4-oxa-6-azabicyclo[3.3.1]non-7-ene-6-carboxylate

Systemtic Name: methyl (1S,5R)-9-iodanyl-3-oxidanylidene-2-prop-2-enyl-4-oxa-6-azabicyclo[3.3.1]non-7-ene-6-carboxylate Openeye Name: methyl (1S,5R)-2-allyl-9-iodo-3-oxo-4-oxa-6-azabicyclo[3.3.1]non-7-ene-6-carboxylate CAS Name: (1S,5R)-9-iodo-3-oxo-2-prop-2-enyl-4-oxa-6-azabicyclo[3.3.1]non-7-ene-6-carboxylic acid methyl ester IUPAC Name: methyl (1S,5R)-9-iodo-3-oxo-2-prop-2-enyl-4-oxa-6-azabicyclo[3.3.1]non-7-ene-6-carboxylate Traditional Name: (1S,5R)-2-allyl-9-iodo-3-keto-4-oxa-6-azabicyclo[3.3.1]non-7-ene-6-carboxylic acid methyl ester Formula: C12H14INO4 MolecularWeight: 363.14833

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C=CC2C(C(=O)OC1C2I)CC=C

Isomeric SMILES

COC(=O)N1C=C[C@H]2C(C(=O)O[C@@H]1C2I)CC=C

InChI

InChI=1S/C12H14INO4/c1-3-4-8-7-5-6-14(12(16)17-2)10(9(7)13)18-11(8)15/h3,5-10H,1,4H2,2H3/t7-,8?,9?,10+/m0/s1