(phenylmethyl) 7-azido-3-(5-methylfuran-2-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (phenylmethyl) 7-azido-3-(5-methylfuran-2-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzyl 7-azido-3-(5-methyl-2-furyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-azido-3-(5-methyl-2-furanyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 7-azido-3-(5-methylfuran-2-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-azido-8-keto-3-(5-methyl-2-furyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzyl ester Formula: C19H16N4O4S MolecularWeight: 396.41974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=C(N3C(C(C3=O)N=[N+]=[N-])SC2)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(O1)C2=C(N3C(C(C3=O)N=[N+]=[N-])SC2)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C19H16N4O4S/c1-11-7-8-14(27-11)13-10-28-18-15(21-22-20)17(24)23(18)16(13)19(25)26-9-12-5-3-2-4-6-12/h2-8,15,18H,9-10H2,1H3