methyl (E)-2-bromanyl-5-[(4-methylphenyl)sulfonylamino]pent-2-enoate

Systemtic Name: methyl (E)-2-bromanyl-5-[(4-methylphenyl)sulfonylamino]pent-2-enoate Openeye Name: methyl (E)-2-bromo-5-(p-tolylsulfonylamino)pent-2-enoate CAS Name: (E)-2-bromo-5-[(4-methylphenyl)sulfonylamino]-2-pentenoic acid methyl ester IUPAC Name: methyl (E)-2-bromo-5-[(4-methylphenyl)sulfonylamino]pent-2-enoate Traditional Name: (E)-2-bromo-5-(tosylamino)pent-2-enoic acid methyl ester Formula: C13H16BrNO4S MolecularWeight: 362.23944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC=C(C(=O)OC)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC/C=C(\C(=O)OC)/Br

InChI

InChI=1S/C13H16BrNO4S/c1-10-5-7-11(8-6-10)20(17,18)15-9-3-4-12(14)13(16)19-2/h4-8,15H,3,9H2,1-2H3/b12-4+