methyl 2-[2-[(5-bromanyl-2-methoxy-phenyl)sulfonylamino]ethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[2-[(5-bromanyl-2-methoxy-phenyl)sulfonylamino]ethanoylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-[(5-bromo-2-methoxy-phenyl)sulfonylamino]acetyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(5-bromo-2-methoxyphenyl)sulfonylamino]acetyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(5-bromo-2-methoxy-phenyl)sulfonylamino]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C16H23BrN2O6S MolecularWeight: 451.33262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23BrN2O6S/c1-10(2)7-12(16(21)25-4)19-15(20)9-18-26(22,23)14-8-11(17)5-6-13(14)24-3/h5-6,8,10,12,18H,7,9H2,1-4H3,(H,19,20)