(phenylmethyl) (2S,5R)-3,3-dimethyl-7-oxidanylidene-6-prop-1-enylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (phenylmethyl) (2S,5R)-3,3-dimethyl-7-oxidanylidene-6-prop-1-enylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: benzyl (2S,5R)-3,3-dimethyl-7-oxo-6-prop-1-enylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: (2S,5R)-3,3-dimethyl-7-oxo-6-prop-1-enylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,5R)-3,3-dimethyl-7-oxo-6-prop-1-enylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: (2S,5R)-7-keto-3,3-dimethyl-6-prop-1-enylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzyl ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC=C=C1C2N(C1=O)C(C(S2)(C)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC=C=C1[C@@H]2N(C1=O)[C@H](C(S2)(C)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H19NO3S/c1-4-8-13-15(20)19-14(18(2,3)23-16(13)19)17(21)22-11-12-9-6-5-7-10-12/h4-7,9-10,14,16H,11H2,1-3H3/t8?,14-,16+/m0/s1