2-(4-chlorophenyl)sulfonyl-3-(2-hexoxy-3-methoxy-phenyl)prop-2-enenitrile

Systemtic Name: 2-(4-chlorophenyl)sulfonyl-3-(2-hexoxy-3-methoxy-phenyl)prop-2-enenitrile Openeye Name: 2-(4-chlorophenyl)sulfonyl-3-(2-hexoxy-3-methoxy-phenyl)prop-2-enenitrile CAS Name: 2-(4-chlorophenyl)sulfonyl-3-(2-hexoxy-3-methoxyphenyl)-2-propenenitrile IUPAC Name: 2-(4-chlorophenyl)sulfonyl-3-(2-hexoxy-3-methoxyphenyl)prop-2-enenitrile Traditional Name: 2-(4-chlorophenyl)sulfonyl-3-(2-hexoxy-3-methoxy-phenyl)acrylonitrile Formula: C22H24ClNO4S MolecularWeight: 433.94826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=CC=C1OC)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCOC1=C(C=CC=C1OC)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

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