3-(3-ethoxy-4-hexoxy-phenyl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-(3-ethoxy-4-hexoxy-phenyl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-(3-ethoxy-4-hexoxy-phenyl)-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-(3-ethoxy-4-hexoxyphenyl)-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-(3-ethoxy-4-hexoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-(3-ethoxy-4-hexoxy-phenyl)-2-tosyl-acrylonitrile Formula: C24H29NO4S MolecularWeight: 427.55636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)C)OCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)C)OCC

InChI

InChI=1S/C24H29NO4S/c1-4-6-7-8-15-29-23-14-11-20(17-24(23)28-5-2)16-22(18-25)30(26,27)21-12-9-19(3)10-13-21/h9-14,16-17H,4-8,15H2,1-3H3