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

Systemtic Name: 3-[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-[3-methoxy-2-(p-tolylmethoxy)phenyl]-2-(p-tolylsulfonyl)prop-2-enenitrile CAS Name: 3-[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-[3-methoxy-2-[(4-methylphenyl)methoxy]phenyl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile Traditional Name: 3-[3-methoxy-2-(4-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)COC2=C(C=CC=C2OC)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=CC=C2OC)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)C

InChI

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