methyl (Z)-4-bromanyl-2-(5-methoxy-3-methyl-6-oxidanylidene-4-thia-2-aza-6-azoniabicyclo[3.2.0]hept-2-en-7-yl)-3-methyl-but-2-enoate

Systemtic Name: methyl (Z)-4-bromanyl-2-(5-methoxy-3-methyl-6-oxidanylidene-4-thia-2-aza-6-azoniabicyclo[3.2.0]hept-2-en-7-yl)-3-methyl-but-2-enoate Openeye Name: methyl (Z)-4-bromo-2-(5-methoxy-3-methyl-6-oxo-4-thia-2-aza-6-azoniabicyclo[3.2.0]hept-2-en-7-yl)-3-methyl-but-2-enoate CAS Name: (Z)-4-bromo-2-(5-methoxy-3-methyl-6-oxo-4-thia-2-aza-6-azoniabicyclo[3.2.0]hept-2-en-7-yl)-3-methyl-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-4-bromo-2-(5-methoxy-3-methyl-6-oxo-4-thia-2-aza-6-azoniabicyclo[3.2.0]hept-2-en-7-yl)-3-methylbut-2-enoate Traditional Name: (Z)-4-bromo-2-(6-keto-5-methoxy-3-methyl-4-thia-2-aza-6-azoniabicyclo[3.2.0]hept-2-en-7-yl)-3-methyl-but-2-enoic acid methyl ester Formula: C12H16BrN2O4S+ MolecularWeight: 364.23544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2C([N+](=O)C2(S1)OC)C(=C(C)CBr)C(=O)OC

Isomeric SMILES

CC1=NC2C([N+](=O)C2(S1)OC)/C(=C(\C)/CBr)/C(=O)OC

InChI

InChI=1S/C12H16BrN2O4S/c1-6(5-13)8(11(16)18-3)9-10-12(19-4,15(9)17)20-7(2)14-10/h9-10H,5H2,1-4H3/q+1/b8-6-