(phenylmethyl) 3,3-dimethyl-6-[2-(methylamino)-1-oxidanyl-2-oxidanylidene-ethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (phenylmethyl) 3,3-dimethyl-6-[2-(methylamino)-1-oxidanyl-2-oxidanylidene-ethyl]-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: benzyl 6-[1-hydroxy-2-(methylamino)-2-oxo-ethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-[1-hydroxy-2-(methylamino)-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-[1-hydroxy-2-(methylamino)-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-[1-hydroxy-2-keto-2-(methylamino)ethyl]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzyl ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)C(C(=O)NC)O)C(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)C(C(=O)NC)O)C(=O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C18H22N2O5S/c1-18(2)13(17(24)25-9-10-7-5-4-6-8-10)20-15(23)11(16(20)26-18)12(21)14(22)19-3/h4-8,11-13,16,21H,9H2,1-3H3,(H,19,22)