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

Systemtic Name: methyl 3-[2-chloranylprop-2-enyl-(4-methylphenyl)sulfonyl-amino]propanoate Openeye Name: methyl 3-[2-chloroallyl(p-tolylsulfonyl)amino]propanoate CAS Name: 3-[2-chloroprop-2-enyl-(4-methylphenyl)sulfonylamino]propanoic acid methyl ester IUPAC Name: methyl 3-[2-chloroprop-2-enyl-(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-[2-chloroallyl(tosyl)amino]propionic acid methyl ester Formula: C14H18ClNO4S MolecularWeight: 331.81502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18ClNO4S/c1-11-4-6-13(7-5-11)21(18,19)16(10-12(2)15)9-8-14(17)20-3/h4-7H,2,8-10H2,1,3H3