chloromethyl 6-isocyano-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: chloromethyl 6-isocyano-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: chloromethyl 6-isocyano-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-isocyano-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid chloromethyl ester IUPAC Name: chloromethyl 6-isocyano-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-isocyano-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid chloromethyl ester Formula: C10H11ClN2O3S MolecularWeight: 274.72394

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)[N+]#[C-])C(=O)OCCl)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)[N+]#[C-])C(=O)OCCl)C

InChI

InChI=1S/C10H11ClN2O3S/c1-10(2)6(9(15)16-4-11)13-7(14)5(12-3)8(13)17-10/h5-6,8H,4H2,1-2H3