ethyl (E)-3-[[3-(trifluoromethylsulfanyl)phenyl]methoxycarbonylamino]but-2-enoate

Systemtic Name: ethyl (E)-3-[[3-(trifluoromethylsulfanyl)phenyl]methoxycarbonylamino]but-2-enoate Openeye Name: ethyl (E)-3-[[3-(trifluoromethylsulfanyl)phenyl]methoxycarbonylamino]but-2-enoate CAS Name: (E)-3-[[oxo-[[3-(trifluoromethylthio)phenyl]methoxy]methyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[[3-(trifluoromethylsulfanyl)phenyl]methoxycarbonylamino]but-2-enoate Traditional Name: (E)-3-[[3-(trifluoromethylthio)benzyl]oxycarbonylamino]but-2-enoic acid ethyl ester Formula: C15H16F3NO4S MolecularWeight: 363.35205

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC(=O)OCC1=CC(=CC=C1)SC(F)(F)F

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC(=O)OCC1=CC(=CC=C1)SC(F)(F)F

InChI

InChI=1S/C15H16F3NO4S/c1-3-22-13(20)7-10(2)19-14(21)23-9-11-5-4-6-12(8-11)24-15(16,17)18/h4-8H,3,9H2,1-2H3,(H,19,21)/b10-7+