(4-methoxyphenyl)methyl 3-(1-acetyloxyethyl)-7-azido-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl 3-(1-acetyloxyethyl)-7-azido-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: (4-methoxyphenyl)methyl 3-(1-acetoxyethyl)-7-azido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-(1-acetyloxyethyl)-7-azido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 3-(1-acetyloxyethyl)-7-azido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-(1-acetoxyethyl)-7-azido-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid p-anisyl ester Formula: C19H20N4O6S MolecularWeight: 432.4503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(N2C(C(C2=O)N=[N+]=[N-])SC1)C(=O)OCC3=CC=C(C=C3)OC)OC(=O)C

Isomeric SMILES

CC(C1=C(N2C(C(C2=O)N=[N+]=[N-])SC1)C(=O)OCC3=CC=C(C=C3)OC)OC(=O)C

InChI

InChI=1S/C19H20N4O6S/c1-10(29-11(2)24)14-9-30-18-15(21-22-20)17(25)23(18)16(14)19(26)28-8-12-4-6-13(27-3)7-5-12/h4-7,10,15,18H,8-9H2,1-3H3