methyl (E)-4-[(4-methylphenyl)sulfonylamino]hex-2-enoate

Systemtic Name: methyl (E)-4-[(4-methylphenyl)sulfonylamino]hex-2-enoate Openeye Name: methyl (E)-4-(p-tolylsulfonylamino)hex-2-enoate CAS Name: (E)-4-[(4-methylphenyl)sulfonylamino]-2-hexenoic acid methyl ester IUPAC Name: methyl (E)-4-[(4-methylphenyl)sulfonylamino]hex-2-enoate Traditional Name: (E)-4-(tosylamino)hex-2-enoic acid methyl ester Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=CC(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCC(/C=C/C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C14H19NO4S/c1-4-12(7-10-14(16)19-3)15-20(17,18)13-8-5-11(2)6-9-13/h5-10,12,15H,4H2,1-3H3/b10-7+