methyl (E)-3-[6-fluoranyl-2-[(4-methylphenyl)sulfonyloxymethyl]-3,4-dihydro-2H-chromen-8-yl]prop-2-enoate

Systemtic Name: methyl (E)-3-[6-fluoranyl-2-[(4-methylphenyl)sulfonyloxymethyl]-3,4-dihydro-2H-chromen-8-yl]prop-2-enoate Openeye Name: methyl (E)-3-[6-fluoro-2-(p-tolylsulfonyloxymethyl)chroman-8-yl]prop-2-enoate CAS Name: (E)-3-[6-fluoro-2-[(4-methylphenyl)sulfonyloxymethyl]-3,4-dihydro-2H-1-benzopyran-8-yl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[6-fluoro-2-[(4-methylphenyl)sulfonyloxymethyl]-3,4-dihydro-2H-chromen-8-yl]prop-2-enoate Traditional Name: (E)-3-[6-fluoro-2-(tosyloxymethyl)chroman-8-yl]acrylic acid methyl ester Formula: C21H21FO6S MolecularWeight: 420.451243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCC3=C(O2)C(=CC(=C3)F)C=CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCC3=C(O2)C(=CC(=C3)F)/C=C/C(=O)OC

InChI

InChI=1S/C21H21FO6S/c1-14-3-8-19(9-4-14)29(24,25)27-13-18-7-5-15-11-17(22)12-16(21(15)28-18)6-10-20(23)26-2/h3-4,6,8-12,18H,5,7,13H2,1-2H3/b10-6+