2-[2-(4-chloranylphenoxy)propanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-(4-chloranylphenoxy)propanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[2-(4-chlorophenoxy)propanoylamino]-3-methyl-butanoic acid CAS Name: 2-[[2-(4-chlorophenoxy)-1-oxopropyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[2-(4-chlorophenoxy)propanoylamino]-3-methylbutanoic acid Traditional Name: 2-[2-(4-chlorophenoxy)propanoylamino]-3-methyl-butyric acid Formula: C14H18ClNO4 MolecularWeight: 299.75002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C(C)OC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C(C)OC1=CC=C(C=C1)Cl

InChI

InChI=1S/C14H18ClNO4/c1-8(2)12(14(18)19)16-13(17)9(3)20-11-6-4-10(15)5-7-11/h4-9,12H,1-3H3,(H,16,17)(H,18,19)