2-(4-chlorophenyl)sulfonyl-3-(3-ethoxy-4-pentoxy-phenyl)prop-2-enenitrile

Systemtic Name: 2-(4-chlorophenyl)sulfonyl-3-(3-ethoxy-4-pentoxy-phenyl)prop-2-enenitrile Openeye Name: 2-(4-chlorophenyl)sulfonyl-3-(3-ethoxy-4-pentoxy-phenyl)prop-2-enenitrile CAS Name: 2-(4-chlorophenyl)sulfonyl-3-(3-ethoxy-4-pentoxyphenyl)-2-propenenitrile IUPAC Name: 2-(4-chlorophenyl)sulfonyl-3-(3-ethoxy-4-pentoxyphenyl)prop-2-enenitrile Traditional Name: 3-(4-amoxy-3-ethoxy-phenyl)-2-(4-chlorophenyl)sulfonyl-acrylonitrile Formula: C22H24ClNO4S MolecularWeight: 433.94826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl)OCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl)OCC

InChI

InChI=1S/C22H24ClNO4S/c1-3-5-6-13-28-21-12-7-17(15-22(21)27-4-2)14-20(16-24)29(25,26)19-10-8-18(23)9-11-19/h7-12,14-15H,3-6,13H2,1-2H3