3-[4-[(4-tert-butylphenyl)methoxy]phenyl]-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-[4-[(4-tert-butylphenyl)methoxy]phenyl]-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-[4-[(4-tert-butylphenyl)methoxy]phenyl]-2-(4-chlorophenyl)sulfonyl-prop-2-enenitrile CAS Name: 3-[4-[(4-tert-butylphenyl)methoxy]phenyl]-2-(4-chlorophenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-[4-[(4-tert-butylphenyl)methoxy]phenyl]-2-(4-chlorophenyl)sulfonylprop-2-enenitrile Traditional Name: 3-[4-(4-tert-butylbenzyl)oxyphenyl]-2-(4-chlorophenyl)sulfonyl-acrylonitrile Formula: C26H24ClNO3S MolecularWeight: 465.99166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC2=CC=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC2=CC=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H24ClNO3S/c1-26(2,3)21-8-4-20(5-9-21)18-31-23-12-6-19(7-13-23)16-25(17-28)32(29,30)24-14-10-22(27)11-15-24/h4-16H,18H2,1-3H3