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

Systemtic Name: 3-[3-methoxy-4-[(2-methylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-[3-methoxy-4-(o-tolylmethoxy)phenyl]-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-[3-methoxy-4-[(2-methylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-[3-methoxy-4-[(2-methylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-[3-methoxy-4-(2-methylbenzyl)oxy-phenyl]-2-tosyl-acrylonitrile Formula: C25H23NO4S MolecularWeight: 433.51942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=CC=C3C)OC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=CC=C3C)OC)C#N

InChI

InChI=1S/C25H23NO4S/c1-18-8-11-22(12-9-18)31(27,28)23(16-26)14-20-10-13-24(25(15-20)29-3)30-17-21-7-5-4-6-19(21)2/h4-15H,17H2,1-3H3