ethyl (E)-2-cyano-3-[3-methoxy-4-(phenylsulfonyloxy)phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[3-methoxy-4-(phenylsulfonyloxy)phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-(benzenesulfonyloxy)-3-methoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-(benzenesulfonyloxy)-3-methoxyphenyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-(benzenesulfonyloxy)-3-methoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-(4-besyloxy-3-methoxy-phenyl)-2-cyano-acrylic acid ethyl ester Formula: C19H17NO6S MolecularWeight: 387.40638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)OC)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)OC)/C#N

InChI

InChI=1S/C19H17NO6S/c1-3-25-19(21)15(13-20)11-14-9-10-17(18(12-14)24-2)26-27(22,23)16-7-5-4-6-8-16/h4-12H,3H2,1-2H3/b15-11+