3-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-[3-[(3,5-dimethylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-[3-(3,5-dimethylbenzyl)oxyphenyl]-2-tosyl-acrylonitrile Formula: C25H23NO3S MolecularWeight: 417.52002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=CC=C2)OCC3=CC(=CC(=C3)C)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=CC=C2)OCC3=CC(=CC(=C3)C)C)C#N

InChI

InChI=1S/C25H23NO3S/c1-18-7-9-24(10-8-18)30(27,28)25(16-26)15-21-5-4-6-23(14-21)29-17-22-12-19(2)11-20(3)13-22/h4-15H,17H2,1-3H3