(E,4S)-2,4-bis[(4-chlorophenyl)sulfonyl]-5-oxidanylidene-hex-2-enenitrile

Systemtic Name: (E,4S)-2,4-bis[(4-chlorophenyl)sulfonyl]-5-oxidanylidene-hex-2-enenitrile Openeye Name: (E,4S)-2,4-bis[(4-chlorophenyl)sulfonyl]-5-oxo-hex-2-enenitrile CAS Name: (E,4S)-2,4-bis[(4-chlorophenyl)sulfonyl]-5-oxo-2-hexenenitrile IUPAC Name: (E,4S)-2,4-bis[(4-chlorophenyl)sulfonyl]-5-oxohex-2-enenitrile Traditional Name: (E,4S)-2,4-bis[(4-chlorophenyl)sulfonyl]-5-keto-hex-2-enenitrile Formula: C18H13Cl2NO5S2 MolecularWeight: 458.33552

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C=C(C#N)S(=O)(=O)C1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=O)[C@H](/C=C(\C#N)/S(=O)(=O)C1=CC=C(C=C1)Cl)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H13Cl2NO5S2/c1-12(22)18(28(25,26)16-8-4-14(20)5-9-16)10-17(11-21)27(23,24)15-6-2-13(19)3-7-15/h2-10,18H,1H3/b17-10+/t18-/m0/s1