ethyl 2-[2-[3,5-bis(trifluoromethyl)phenyl]sulfonylethyl]-2-cyano-pent-4-enoate

Systemtic Name: ethyl 2-[2-[3,5-bis(trifluoromethyl)phenyl]sulfonylethyl]-2-cyano-pent-4-enoate Openeye Name: ethyl 2-[2-[3,5-bis(trifluoromethyl)phenyl]sulfonylethyl]-2-cyano-pent-4-enoate CAS Name: 2-[2-[3,5-bis(trifluoromethyl)phenyl]sulfonylethyl]-2-cyano-4-pentenoic acid ethyl ester IUPAC Name: ethyl 2-[2-[3,5-bis(trifluoromethyl)phenyl]sulfonylethyl]-2-cyanopent-4-enoate Traditional Name: 2-[2-[3,5-bis(trifluoromethyl)phenyl]sulfonylethyl]-2-cyano-pent-4-enoic acid ethyl ester Formula: C18H17F6NO4S MolecularWeight: 457.387299

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCS(=O)(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(CC=C)C#N

Isomeric SMILES

CCOC(=O)C(CCS(=O)(=O)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(CC=C)C#N

InChI

InChI=1S/C18H17F6NO4S/c1-3-5-16(11-25,15(26)29-4-2)6-7-30(27,28)14-9-12(17(19,20)21)8-13(10-14)18(22,23)24/h3,8-10H,1,4-7H2,2H3