3-[3-[(2-fluorophenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-[3-[(2-fluorophenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-[3-[(2-fluorophenyl)methoxy]phenyl]-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-[3-[(2-fluorophenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-[3-[(2-fluorophenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-[3-(2-fluorobenzyl)oxyphenyl]-2-tosyl-acrylonitrile Formula: C23H18FNO3S MolecularWeight: 407.457323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=CC=C2)OCC3=CC=CC=C3F)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=CC=C2)OCC3=CC=CC=C3F)C#N

InChI

InChI=1S/C23H18FNO3S/c1-17-9-11-21(12-10-17)29(26,27)22(15-25)14-18-5-4-7-20(13-18)28-16-19-6-2-3-8-23(19)24/h2-14H,16H2,1H3