2-[2-(3-bromanylphenoxy)ethanoylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[2-(3-bromanylphenoxy)ethanoylamino]-3-methyl-pentanoic acid Openeye Name: 2-[[2-(3-bromophenoxy)acetyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[2-(3-bromophenoxy)-1-oxoethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[2-(3-bromophenoxy)acetyl]amino]-3-methylpentanoic acid Traditional Name: 2-[[2-(3-bromophenoxy)acetyl]amino]-3-methyl-valeric acid Formula: C14H18BrNO4 MolecularWeight: 344.20102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)NC(=O)COC1=CC(=CC=C1)Br

Isomeric SMILES

CCC(C)C(C(=O)O)NC(=O)COC1=CC(=CC=C1)Br

InChI

InChI=1S/C14H18BrNO4/c1-3-9(2)13(14(18)19)16-12(17)8-20-11-6-4-5-10(15)7-11/h4-7,9,13H,3,8H2,1-2H3,(H,16,17)(H,18,19)