3-(3-ethoxy-4-propoxy-phenyl)-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: 3-(3-ethoxy-4-propoxy-phenyl)-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-(3-ethoxy-4-propoxy-phenyl)prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-(3-ethoxy-4-propoxyphenyl)-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-(3-ethoxy-4-propoxyphenyl)prop-2-enenitrile Traditional Name: 2-besyl-3-(3-ethoxy-4-propoxy-phenyl)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=CC=C2)OCC

Isomeric SMILES

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

InChI

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