1-propan-2-yloxycarbonyloxyethyl (6S)-3-(dimethylcarbamoyloxymethyl)-7-formamido-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 1-propan-2-yloxycarbonyloxyethyl (6S)-3-(dimethylcarbamoyloxymethyl)-7-formamido-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 1-isopropoxycarbonyloxyethyl (6S)-3-(dimethylcarbamoyloxymethyl)-7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: (6S)-3-[[dimethylamino(oxo)methoxy]methyl]-7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 1-[oxo(propan-2-yloxy)methoxy]ethyl ester IUPAC Name: 1-propan-2-yloxycarbonyloxyethyl (6S)-3-(dimethylcarbamoyloxymethyl)-7-formamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: (6S)-3-(dimethylcarbamoyloxymethyl)-7-formamido-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid 1-isopropoxycarbonyloxyethyl ester Formula: C18H25N3O9S MolecularWeight: 459.4708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)OC(C)OC(=O)C1=C(CSC2N1C(=O)C2NC=O)COC(=O)N(C)C

Isomeric SMILES

CC(C)OC(=O)OC(C)OC(=O)C1=C(CS[C@@H]2N1C(=O)C2NC=O)COC(=O)N(C)C

InChI

InChI=1S/C18H25N3O9S/c1-9(2)28-18(26)30-10(3)29-16(24)13-11(6-27-17(25)20(4)5)7-31-15-12(19-8-22)14(23)21(13)15/h8-10,12,15H,6-7H2,1-5H3,(H,19,22)/t10?,12?,15-/m0/s1