methyl 3-[2-[[(E)-2-methylbut-2-enyl]-(4-methylphenyl)sulfonyl-amino]phenyl]prop-2-ynoate

Systemtic Name: methyl 3-[2-[[(E)-2-methylbut-2-enyl]-(4-methylphenyl)sulfonyl-amino]phenyl]prop-2-ynoate Openeye Name: methyl 3-[2-[[(E)-2-methylbut-2-enyl]-(p-tolylsulfonyl)amino]phenyl]prop-2-ynoate CAS Name: 3-[2-[[(E)-2-methylbut-2-enyl]-(4-methylphenyl)sulfonylamino]phenyl]-2-propynoic acid methyl ester IUPAC Name: methyl 3-[2-[[(E)-2-methylbut-2-enyl]-(4-methylphenyl)sulfonylamino]phenyl]prop-2-ynoate Traditional Name: 3-[2-[[(E)-2-methylbut-2-enyl]-tosyl-amino]phenyl]propiolic acid methyl ester Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)CN(C1=CC=CC=C1C#CC(=O)OC)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

C/C=C(\C)/CN(C1=CC=CC=C1C#CC(=O)OC)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H23NO4S/c1-5-17(2)16-23(28(25,26)20-13-10-18(3)11-14-20)21-9-7-6-8-19(21)12-15-22(24)27-4/h5-11,13-14H,16H2,1-4H3/b17-5+