2-(4-chlorophenyl)sulfonyl-3-(2-hexoxyphenyl)prop-2-enenitrile

Systemtic Name: 2-(4-chlorophenyl)sulfonyl-3-(2-hexoxyphenyl)prop-2-enenitrile Openeye Name: 2-(4-chlorophenyl)sulfonyl-3-(2-hexoxyphenyl)prop-2-enenitrile CAS Name: 2-(4-chlorophenyl)sulfonyl-3-(2-hexoxyphenyl)-2-propenenitrile IUPAC Name: 2-(4-chlorophenyl)sulfonyl-3-(2-hexoxyphenyl)prop-2-enenitrile Traditional Name: 2-(4-chlorophenyl)sulfonyl-3-(2-hexoxyphenyl)acrylonitrile Formula: C21H22ClNO3S MolecularWeight: 403.92228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H22ClNO3S/c1-2-3-4-7-14-26-21-9-6-5-8-17(21)15-20(16-23)27(24,25)19-12-10-18(22)11-13-19/h5-6,8-13,15H,2-4,7,14H2,1H3