ethyl (2E)-2-[4-(4-fluorophenyl)-1-(4-methylphenyl)sulfonyl-azetidin-2-ylidene]ethanoate

Systemtic Name: ethyl (2E)-2-[4-(4-fluorophenyl)-1-(4-methylphenyl)sulfonyl-azetidin-2-ylidene]ethanoate Openeye Name: ethyl (2E)-2-[4-(4-fluorophenyl)-1-(p-tolylsulfonyl)azetidin-2-ylidene]acetate CAS Name: (2E)-2-[4-(4-fluorophenyl)-1-(4-methylphenyl)sulfonyl-2-azetidinylidene]acetic acid ethyl ester IUPAC Name: ethyl (2E)-2-[4-(4-fluorophenyl)-1-(4-methylphenyl)sulfonylazetidin-2-ylidene]acetate Traditional Name: (2E)-2-[4-(4-fluorophenyl)-1-tosyl-azetidin-2-ylidene]acetic acid ethyl ester Formula: C20H20FNO4S MolecularWeight: 389.440503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C1CC(N1S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)/C=C/1\CC(N1S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H20FNO4S/c1-3-26-20(23)13-17-12-19(15-6-8-16(21)9-7-15)22(17)27(24,25)18-10-4-14(2)5-11-18/h4-11,13,19H,3,12H2,1-2H3/b17-13+