3-[3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-[3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-[3-[(2-chloro-6-fluoro-phenyl)methoxy]phenyl]-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-[3-(2-chloro-6-fluoro-benzyl)oxyphenyl]-2-tosyl-acrylonitrile Formula: C23H17ClFNO3S MolecularWeight: 441.902383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=CC=C2)OCC3=C(C=CC=C3Cl)F)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=CC=C2)OCC3=C(C=CC=C3Cl)F)C#N

InChI

InChI=1S/C23H17ClFNO3S/c1-16-8-10-19(11-9-16)30(27,28)20(14-26)13-17-4-2-5-18(12-17)29-15-21-22(24)6-3-7-23(21)25/h2-13H,15H2,1H3