methyl 7-oxidanylidene-6-phenyl-5-(trifluoromethyl)-8-oxa-2-thia-6-azabicyclo[3.2.1]oct-3-ene-3-carboxylate

Systemtic Name: methyl 7-oxidanylidene-6-phenyl-5-(trifluoromethyl)-8-oxa-2-thia-6-azabicyclo[3.2.1]oct-3-ene-3-carboxylate Openeye Name: methyl 7-oxo-6-phenyl-5-(trifluoromethyl)-8-oxa-2-thia-6-azabicyclo[3.2.1]oct-3-ene-3-carboxylate CAS Name: 7-oxo-6-phenyl-5-(trifluoromethyl)-8-oxa-2-thia-6-azabicyclo[3.2.1]oct-3-ene-3-carboxylic acid methyl ester IUPAC Name: methyl 7-oxo-6-phenyl-5-(trifluoromethyl)-8-oxa-2-thia-6-azabicyclo[3.2.1]oct-3-ene-3-carboxylate Traditional Name: 7-keto-6-phenyl-5-(trifluoromethyl)-8-oxa-2-thia-6-azabicyclo[3.2.1]oct-3-ene-3-carboxylic acid methyl ester Formula: C14H10F3NO4S MolecularWeight: 345.29371

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2(N(C(=O)C(O2)S1)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC2(N(C(=O)C(O2)S1)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C14H10F3NO4S/c1-21-11(20)9-7-13(14(15,16)17)18(8-5-3-2-4-6-8)10(19)12(22-13)23-9/h2-7,12H,1H3