methyl (1S,2S,4R,5R)-4-bromanyl-2-ethyl-3-oxidanylidene-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylate

Systemtic Name: methyl (1S,2S,4R,5R)-4-bromanyl-2-ethyl-3-oxidanylidene-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylate Openeye Name: methyl (1S,2S,4R,5R)-4-bromo-2-ethyl-3-oxo-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylate CAS Name: (1S,2S,4R,5R)-4-bromo-2-ethyl-3-oxo-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylic acid methyl ester IUPAC Name: methyl (1S,2S,4R,5R)-4-bromo-2-ethyl-3-oxo-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylate Traditional Name: (1S,2S,4R,5R)-4-bromo-2-ethyl-3-keto-8-azabicyclo[3.2.1]oct-6-ene-8-carboxylic acid methyl ester Formula: C11H14BrNO3 MolecularWeight: 288.13776

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2C=CC(N2C(=O)OC)C(C1=O)Br

Isomeric SMILES

CC[C@H]1[C@@H]2C=C[C@@H](N2C(=O)OC)[C@H](C1=O)Br

InChI

InChI=1S/C11H14BrNO3/c1-3-6-7-4-5-8(9(12)10(6)14)13(7)11(15)16-2/h4-9H,3H2,1-2H3/t6-,7-,8+,9+/m0/s1