ethyl 2-ethoxy-3-[4-[[(E)-3-(4-methylsulfonyloxyphenyl)prop-2-enoyl]amino]phenyl]propanoate

Systemtic Name: ethyl 2-ethoxy-3-[4-[[(E)-3-(4-methylsulfonyloxyphenyl)prop-2-enoyl]amino]phenyl]propanoate Openeye Name: ethyl 2-ethoxy-3-[4-[[(E)-3-(4-methylsulfonyloxyphenyl)prop-2-enoyl]amino]phenyl]propanoate CAS Name: 2-ethoxy-3-[4-[[(E)-3-(4-methylsulfonyloxyphenyl)-1-oxoprop-2-enyl]amino]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-ethoxy-3-[4-[[(E)-3-(4-methylsulfonyloxyphenyl)prop-2-enoyl]amino]phenyl]propanoate Traditional Name: 2-ethoxy-3-[4-[[(E)-3-(4-methylsulfonyloxyphenyl)acryloyl]amino]phenyl]propionic acid ethyl ester Formula: C23H27NO7S MolecularWeight: 461.52798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)OS(=O)(=O)C)C(=O)OCC

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)NC(=O)/C=C/C2=CC=C(C=C2)OS(=O)(=O)C)C(=O)OCC

InChI

InChI=1S/C23H27NO7S/c1-4-29-21(23(26)30-5-2)16-18-6-11-19(12-7-18)24-22(25)15-10-17-8-13-20(14-9-17)31-32(3,27)28/h6-15,21H,4-5,16H2,1-3H3,(H,24,25)/b15-10+