(phenylmethyl) 6-azanyl-3,3-dimethyl-7-oxidanylidene-6-(1-oxidanylidene-1-phenylmethoxy-propan-2-yl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (phenylmethyl) 6-azanyl-3,3-dimethyl-7-oxidanylidene-6-(1-oxidanylidene-1-phenylmethoxy-propan-2-yl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: benzyl 6-amino-6-(2-benzyloxy-1-methyl-2-oxo-ethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-amino-3,3-dimethyl-7-oxo-6-(1-oxo-1-phenylmethoxypropan-2-yl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-amino-3,3-dimethyl-7-oxo-6-(1-oxo-1-phenylmethoxypropan-2-yl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-amino-6-(2-benzoxy-2-keto-1-methyl-ethyl)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzyl ester Formula: C25H28N2O5S MolecularWeight: 468.56522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)C2(C3N(C2=O)C(C(S3)(C)C)C(=O)OCC4=CC=CC=C4)N

Isomeric SMILES

CC(C(=O)OCC1=CC=CC=C1)C2(C3N(C2=O)C(C(S3)(C)C)C(=O)OCC4=CC=CC=C4)N

InChI

InChI=1S/C25H28N2O5S/c1-16(20(28)31-14-17-10-6-4-7-11-17)25(26)22(30)27-19(24(2,3)33-23(25)27)21(29)32-15-18-12-8-5-9-13-18/h4-13,16,19,23H,14-15,26H2,1-3H3