methyl 3,3,4-trimethyl-7-oxidanylidene-6-propan-2-ylidene-4-thionia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: methyl 3,3,4-trimethyl-7-oxidanylidene-6-propan-2-ylidene-4-thionia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: methyl 6-isopropylidene-3,3,4-trimethyl-7-oxo-4-thionia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 3,3,4-trimethyl-7-oxo-6-propan-2-ylidene-4-thionia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid methyl ester IUPAC Name: methyl 3,3,4-trimethyl-7-oxo-6-propan-2-ylidene-4-thionia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-isopropylidene-7-keto-3,3,4-trimethyl-4-thionia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid methyl ester Formula: C13H20NO3S+ MolecularWeight: 270.3678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C2N(C1=O)C(C([S+]2C)(C)C)C(=O)OC)C

Isomeric SMILES

CC(=C1C2N(C1=O)C(C([S+]2C)(C)C)C(=O)OC)C

InChI

InChI=1S/C13H20NO3S/c1-7(2)8-10(15)14-9(12(16)17-5)13(3,4)18(6)11(8)14/h9,11H,1-6H3/q+1