3-[3-[(2,6-dimethylphenoxy)methyl]-4-methoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: 3-[3-[(2,6-dimethylphenoxy)methyl]-4-methoxy-phenyl]-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: 2-(benzenesulfonyl)-3-[3-[(2,6-dimethylphenoxy)methyl]-4-methoxy-phenyl]prop-2-enenitrile CAS Name: 2-(benzenesulfonyl)-3-[3-[(2,6-dimethylphenoxy)methyl]-4-methoxyphenyl]-2-propenenitrile IUPAC Name: 2-(benzenesulfonyl)-3-[3-[(2,6-dimethylphenoxy)methyl]-4-methoxyphenyl]prop-2-enenitrile Traditional Name: 2-besyl-3-[3-[(2,6-dimethylphenoxy)methyl]-4-methoxy-phenyl]acrylonitrile Formula: C25H23NO4S MolecularWeight: 433.51942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC2=C(C=CC(=C2)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC2=C(C=CC(=C2)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)OC

InChI

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