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

Systemtic Name: 3-(2-butoxy-3-methoxy-phenyl)-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-(2-butoxy-3-methoxy-phenyl)-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile CAS Name: 3-(2-butoxy-3-methoxyphenyl)-2-(4-chlorophenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-(2-butoxy-3-methoxyphenyl)-2-(4-chlorophenyl)sulfonylprop-2-enenitrile Traditional Name: 3-(2-butoxy-3-methoxy-phenyl)-2-(4-chlorophenyl)sulfonyl-acrylonitrile Formula: C20H20ClNO4S MolecularWeight: 405.8951

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC=C1OC)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCOC1=C(C=CC=C1OC)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H20ClNO4S/c1-3-4-12-26-20-15(6-5-7-19(20)25-2)13-18(14-22)27(23,24)17-10-8-16(21)9-11-17/h5-11,13H,3-4,12H2,1-2H3