methyl 2-[3-methylbut-2-enyl-(4-methylphenyl)sulfonyl-amino]propanoate

Systemtic Name: methyl 2-[3-methylbut-2-enyl-(4-methylphenyl)sulfonyl-amino]propanoate Openeye Name: methyl 2-[3-methylbut-2-enyl(p-tolylsulfonyl)amino]propanoate CAS Name: 2-[3-methylbut-2-enyl-(4-methylphenyl)sulfonylamino]propanoic acid methyl ester IUPAC Name: methyl 2-[3-methylbut-2-enyl-(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 2-[3-methylbut-2-enyl(tosyl)amino]propionic acid methyl ester Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC=C(C)C)C(C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC=C(C)C)C(C)C(=O)OC

InChI

InChI=1S/C16H23NO4S/c1-12(2)10-11-17(14(4)16(18)21-5)22(19,20)15-8-6-13(3)7-9-15/h6-10,14H,11H2,1-5H3