1-chloroethyl 6-bromanyl-6-(hydroxymethyl)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: 1-chloroethyl 6-bromanyl-6-(hydroxymethyl)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: 1-chloroethyl 6-bromo-6-(hydroxymethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-bromo-6-(hydroxymethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 1-chloroethyl ester IUPAC Name: 1-chloroethyl 6-bromo-6-(hydroxymethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-bromo-7-keto-3,3-dimethyl-6-methylol-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 1-chloroethyl ester Formula: C11H15BrClNO4S MolecularWeight: 372.6631

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Descriptors Computed from Structure

Canonical SMILES:

CC(OC(=O)C1C(SC2N1C(=O)C2(CO)Br)(C)C)Cl

Isomeric SMILES

CC(OC(=O)C1C(SC2N1C(=O)C2(CO)Br)(C)C)Cl

InChI

InChI=1S/C11H15BrClNO4S/c1-5(13)18-7(16)6-10(2,3)19-9-11(12,4-15)8(17)14(6)9/h5-6,9,15H,4H2,1-3H3