methyl 2-[2-[(5-bromanyl-2-methoxy-phenyl)sulfonylamino]ethanoylamino]hexanoate

Systemtic Name: methyl 2-[2-[(5-bromanyl-2-methoxy-phenyl)sulfonylamino]ethanoylamino]hexanoate Openeye Name: methyl 2-[[2-[(5-bromo-2-methoxy-phenyl)sulfonylamino]acetyl]amino]hexanoate CAS Name: 2-[[2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-1-oxoethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(5-bromo-2-methoxyphenyl)sulfonylamino]acetyl]amino]hexanoate Traditional Name: 2-[[2-[(5-bromo-2-methoxy-phenyl)sulfonylamino]acetyl]amino]hexanoic acid methyl ester Formula: C16H23BrN2O6S MolecularWeight: 451.33262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC)NC(=O)CNS(=O)(=O)C1=C(C=CC(=C1)Br)OC

Isomeric SMILES

CCCCC(C(=O)OC)NC(=O)CNS(=O)(=O)C1=C(C=CC(=C1)Br)OC

InChI

InChI=1S/C16H23BrN2O6S/c1-4-5-6-12(16(21)25-3)19-15(20)10-18-26(22,23)14-9-11(17)7-8-13(14)24-2/h7-9,12,18H,4-6,10H2,1-3H3,(H,19,20)