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

Systemtic Name: (4-methoxyphenyl)methyl 7-azanyl-3-(methoxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: (4-methoxyphenyl)methyl 7-amino-3-(methoxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-amino-3-(methoxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 7-amino-3-(methoxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-amino-8-keto-3-(methoxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid p-anisyl ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(N2C(C(C2=O)N)SC1)C(=O)OCC3=CC=C(C=C3)OC

Isomeric SMILES

COCC1=C(N2C(C(C2=O)N)SC1)C(=O)OCC3=CC=C(C=C3)OC

InChI

InChI=1S/C17H20N2O5S/c1-22-8-11-9-25-16-13(18)15(20)19(16)14(11)17(21)24-7-10-3-5-12(23-2)6-4-10/h3-6,13,16H,7-9,18H2,1-2H3