methyl (E)-3-[(3-fluorophenyl)amino]-2-methylsulfonyl-prop-2-enoate

Systemtic Name: methyl (E)-3-[(3-fluorophenyl)amino]-2-methylsulfonyl-prop-2-enoate Openeye Name: methyl (E)-3-(3-fluoroanilino)-2-methylsulfonyl-prop-2-enoate CAS Name: (E)-3-(3-fluoroanilino)-2-methylsulfonyl-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(3-fluoroanilino)-2-methylsulfonylprop-2-enoate Traditional Name: (E)-3-(3-fluoroanilino)-2-mesyl-acrylic acid methyl ester Formula: C11H12FNO4S MolecularWeight: 273.280683

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CNC1=CC(=CC=C1)F)S(=O)(=O)C

Isomeric SMILES

COC(=O)/C(=C\NC1=CC(=CC=C1)F)/S(=O)(=O)C

InChI

InChI=1S/C11H12FNO4S/c1-17-11(14)10(18(2,15)16)7-13-9-5-3-4-8(12)6-9/h3-7,13H,1-2H3/b10-7+