2-[2-[(4-bromophenyl)sulfonylamino]ethanoylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-[(4-bromophenyl)sulfonylamino]ethanoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-[(4-bromophenyl)sulfonylamino]acetyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[(4-bromophenyl)sulfonylamino]-1-oxoethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-[(4-bromophenyl)sulfonylamino]acetyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-(brosylamino)acetyl]amino]-4-methyl-valeric acid Formula: C14H19BrN2O5S MolecularWeight: 407.28006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19BrN2O5S/c1-9(2)7-12(14(19)20)17-13(18)8-16-23(21,22)11-5-3-10(15)4-6-11/h3-6,9,12,16H,7-8H2,1-2H3,(H,17,18)(H,19,20)