methyl 7-(2-chloranylethanoylamino)-7-methoxy-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: methyl 7-(2-chloranylethanoylamino)-7-methoxy-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: methyl 7-[(2-chloroacetyl)amino]-7-methoxy-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-[(2-chloro-1-oxoethyl)amino]-7-methoxy-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid methyl ester IUPAC Name: methyl 7-[(2-chloroacetyl)amino]-7-methoxy-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-[(2-chloroacetyl)amino]-8-keto-7-methoxy-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid methyl ester Formula: C12H15ClN2O5S MolecularWeight: 334.7759

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)(NC(=O)CCl)OC)SC1)C(=O)OC

Isomeric SMILES

CC1=C(N2C(C(C2=O)(NC(=O)CCl)OC)SC1)C(=O)OC

InChI

InChI=1S/C12H15ClN2O5S/c1-6-5-21-11-12(20-3,14-7(16)4-13)10(18)15(11)8(6)9(17)19-2/h11H,4-5H2,1-3H3,(H,14,16)