methyl 7-acetamido-8-oxidanylidene-3-(prop-2-enoxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: methyl 7-acetamido-8-oxidanylidene-3-(prop-2-enoxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: methyl 7-acetamido-3-(allyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-acetamido-8-oxo-3-(prop-2-enoxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid methyl ester IUPAC Name: methyl 7-acetamido-8-oxo-3-(prop-2-enoxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-acetamido-3-(allyloxymethyl)-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid methyl ester Formula: C14H18N2O5S MolecularWeight: 326.36812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C2N(C1=O)C(=C(CS2)COCC=C)C(=O)OC

Isomeric SMILES

CC(=O)NC1C2N(C1=O)C(=C(CS2)COCC=C)C(=O)OC

InChI

InChI=1S/C14H18N2O5S/c1-4-5-21-6-9-7-22-13-10(15-8(2)17)12(18)16(13)11(9)14(19)20-3/h4,10,13H,1,5-7H2,2-3H3,(H,15,17)