(4-cyano-2-methoxy-phenyl) (E)-3-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)prop-2-enoate

Systemtic Name: (4-cyano-2-methoxy-phenyl) (E)-3-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)prop-2-enoate Openeye Name: (4-cyano-2-methoxy-phenyl) (E)-3-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-2-propenoic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) (E)-3-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxy-3-piperidinosulfonyl-phenyl)acrylic acid (4-cyano-2-methoxy-phenyl) ester Formula: C23H24N2O6S MolecularWeight: 456.51146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)OC2=C(C=C(C=C2)C#N)OC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)OC2=C(C=C(C=C2)C#N)OC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H24N2O6S/c1-29-20-10-6-17(15-22(20)32(27,28)25-12-4-3-5-13-25)8-11-23(26)31-19-9-7-18(16-24)14-21(19)30-2/h6-11,14-15H,3-5,12-13H2,1-2H3/b11-8+