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

Systemtic Name: 3-[2-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-[2-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-[2-(4-chlorobenzyl)oxy-3-methoxy-phenyl]-2-tosyl-acrylonitrile Formula: C24H20ClNO4S MolecularWeight: 453.9379

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20ClNO4S/c1-17-6-12-21(13-7-17)31(27,28)22(15-26)14-19-4-3-5-23(29-2)24(19)30-16-18-8-10-20(25)11-9-18/h3-14H,16H2,1-2H3