3,3-dimethyl-7-oxidanylidene-6-[2-[2-(phenylmethoxycarbonylamino)phenyl]ethanoylamino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 3,3-dimethyl-7-oxidanylidene-6-[2-[2-(phenylmethoxycarbonylamino)phenyl]ethanoylamino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-[[2-[2-(benzyloxycarbonylamino)phenyl]acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 3,3-dimethyl-7-oxo-6-[[1-oxo-2-[2-(phenylmethoxycarbonylamino)phenyl]ethyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 3,3-dimethyl-7-oxo-6-[[2-[2-(phenylmethoxycarbonylamino)phenyl]acetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-[[2-[2-(benzyloxycarbonylamino)phenyl]acetyl]amino]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C24H25N3O6S MolecularWeight: 483.5368

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3NC(=O)OCC4=CC=CC=C4)C(=O)O)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3NC(=O)OCC4=CC=CC=C4)C(=O)O)C

InChI

InChI=1S/C24H25N3O6S/c1-24(2)19(22(30)31)27-20(29)18(21(27)34-24)26-17(28)12-15-10-6-7-11-16(15)25-23(32)33-13-14-8-4-3-5-9-14/h3-11,18-19,21H,12-13H2,1-2H3,(H,25,32)(H,26,28)(H,30,31)