(2S,5R,6R)-3,3-dimethyl-4,4,7-tris(oxidanylidene)-6-[[(5S)-5-(phenylsulfonyl)-4,5-dihydro-1,2-oxazol-3-yl]methyl]-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: (2S,5R,6R)-3,3-dimethyl-4,4,7-tris(oxidanylidene)-6-[[(5S)-5-(phenylsulfonyl)-4,5-dihydro-1,2-oxazol-3-yl]methyl]-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: (2S,5R,6R)-6-[[(5S)-5-(benzenesulfonyl)-4,5-dihydroisoxazol-3-yl]methyl]-3,3-dimethyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: (2S,5R,6R)-6-[[(5S)-5-(benzenesulfonyl)-4,5-dihydroisoxazol-3-yl]methyl]-3,3-dimethyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: (2S,5R,6R)-6-[[(5S)-5-(benzenesulfonyl)-4,5-dihydro-1,2-oxazol-3-yl]methyl]-3,3-dimethyl-4,4,7-trioxo-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: (2S,5R,6R)-6-[[(5S)-5-besyl-2-isoxazolin-3-yl]methyl]-4,4,7-triketo-3,3-dimethyl-4$l^{6}-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C18H20N2O8S2 MolecularWeight: 456.49

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1(=O)=O)C(C2=O)CC3=NOC(C3)S(=O)(=O)C4=CC=CC=C4)C(=O)O)C

Isomeric SMILES

CC1([C@@H](N2[C@H](S1(=O)=O)[C@@H](C2=O)CC3=NO[C@H](C3)S(=O)(=O)C4=CC=CC=C4)C(=O)O)C

InChI

InChI=1S/C18H20N2O8S2/c1-18(2)14(17(22)23)20-15(21)12(16(20)30(18,26)27)8-10-9-13(28-19-10)29(24,25)11-6-4-3-5-7-11/h3-7,12-14,16H,8-9H2,1-2H3,(H,22,23)/t12-,13+,14+,16-/m1/s1