[4-[(E)-2-cyano-2-(4-methylphenyl)sulfonyl-ethenyl]-2-methoxy-phenyl] cyclopropanecarboxylate

Systemtic Name: [4-[(E)-2-cyano-2-(4-methylphenyl)sulfonyl-ethenyl]-2-methoxy-phenyl] cyclopropanecarboxylate Openeye Name: [4-[(E)-2-cyano-2-(p-tolylsulfonyl)vinyl]-2-methoxy-phenyl] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [4-[(E)-2-cyano-2-(4-methylphenyl)sulfonylethenyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-2-(4-methylphenyl)sulfonylethenyl]-2-methoxyphenyl] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid [4-[(E)-2-cyano-2-tosyl-vinyl]-2-methoxy-phenyl] ester Formula: C21H19NO5S MolecularWeight: 397.44426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC(=C(C=C2)OC(=O)C3CC3)OC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=CC(=C(C=C2)OC(=O)C3CC3)OC)/C#N

InChI

InChI=1S/C21H19NO5S/c1-14-3-8-17(9-4-14)28(24,25)18(13-22)11-15-5-10-19(20(12-15)26-2)27-21(23)16-6-7-16/h3-5,8-12,16H,6-7H2,1-2H3/b18-11+