3,3-dimethyl-7-oxidanylidene-2-(phenylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 3,3-dimethyl-7-oxidanylidene-2-(phenylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 2-benzyl-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 3,3-dimethyl-7-oxo-2-(phenylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 2-benzyl-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 2-benzyl-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)CC2=O)(CC3=CC=CC=C3)C(=O)O)C

Isomeric SMILES

CC1(C(N2C(S1)CC2=O)(CC3=CC=CC=C3)C(=O)O)C

InChI

InChI=1S/C15H17NO3S/c1-14(2)15(13(18)19,9-10-6-4-3-5-7-10)16-11(17)8-12(16)20-14/h3-7,12H,8-9H2,1-2H3,(H,18,19)