3-(3-methoxy-4-propoxy-phenyl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-(3-methoxy-4-propoxy-phenyl)-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-(3-methoxy-4-propoxy-phenyl)-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-(3-methoxy-4-propoxyphenyl)-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-(3-methoxy-4-propoxyphenyl)-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-(3-methoxy-4-propoxy-phenyl)-2-tosyl-acrylonitrile Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)C)OC

InChI

InChI=1S/C20H21NO4S/c1-4-11-25-19-10-7-16(13-20(19)24-3)12-18(14-21)26(22,23)17-8-5-15(2)6-9-17/h5-10,12-13H,4,11H2,1-3H3