1-[cyano-(3-phenoxyphenyl)methyl]-3-[(E)-3-ethylsulfanyl-2-fluoranyl-3-oxidanylidene-prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate

Systemtic Name: 1-[cyano-(3-phenoxyphenyl)methyl]-3-[(E)-3-ethylsulfanyl-2-fluoranyl-3-oxidanylidene-prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate Openeye Name: 1-[cyano-(3-phenoxyphenyl)methyl]-3-[(E)-3-ethylsulfanyl-2-fluoro-3-oxo-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate CAS Name: 1-[cyano-(3-phenoxyphenyl)methyl]-3-[(E)-3-(ethylthio)-2-fluoro-3-oxoprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylate IUPAC Name: 1-[cyano-(3-phenoxyphenyl)methyl]-3-[(E)-3-ethylsulfanyl-2-fluoro-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate Traditional Name: 1-[cyano-(3-phenoxyphenyl)methyl]-3-[(E)-3-(ethylthio)-2-fluoro-3-keto-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate Formula: C25H23FNO4S- MolecularWeight: 452.517823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C(=CC1C(C1(C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)[O-])(C)C)F

Isomeric SMILES

CCSC(=O)/C(=C\C1C(C1(C(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)[O-])(C)C)/F

InChI

InChI=1S/C25H24FNO4S/c1-4-32-22(28)20(26)14-21-24(2,3)25(21,23(29)30)19(15-27)16-9-8-12-18(13-16)31-17-10-6-5-7-11-17/h5-14,19,21H,4H2,1-3H3,(H,29,30)/p-1/b20-14+