2,2-dimethylpropanoyloxymethyl 8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1,3-diazabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 2,2-dimethylpropanoyloxymethyl 8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1,3-diazabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 2,2-dimethylpropanoyloxymethyl 8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1,3-diazabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-5-thia-1,3-diazabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (2,2-dimethyl-1-oxopropoxy)methyl ester IUPAC Name: 2,2-dimethylpropanoyloxymethyl 8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1,3-diazabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-7-[(2-phenoxyacetyl)amino]-5-thia-1,3-diazabicyclo[4.2.0]oct-2-ene-2-carboxylic acid pivaloyloxymethyl ester Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCOC(=O)C1=NCSC2N1C(=O)C2NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)OCOC(=O)C1=NCSC2N1C(=O)C2NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O7S/c1-20(2,3)19(27)30-11-29-18(26)15-21-10-31-17-14(16(25)23(15)17)22-13(24)9-28-12-7-5-4-6-8-12/h4-8,14,17H,9-11H2,1-3H3,(H,22,24)