2-[4-(4-chloranylbutanoyl)phenyl]propanoic acid

Systemtic Name: 2-[4-(4-chloranylbutanoyl)phenyl]propanoic acid Openeye Name: 2-[4-(4-chlorobutanoyl)phenyl]propanoic acid CAS Name: 2-[4-(4-chloro-1-oxobutyl)phenyl]propanoic acid IUPAC Name: 2-[4-(4-chlorobutanoyl)phenyl]propanoic acid Traditional Name: 2-[4-(4-chlorobutanoyl)phenyl]propionic acid Formula: C13H15ClO3 MolecularWeight: 254.7094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=O)CCCCl)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)C(=O)CCCCl)C(=O)O

InChI

InChI=1S/C13H15ClO3/c1-9(13(16)17)10-4-6-11(7-5-10)12(15)3-2-8-14/h4-7,9H,2-3,8H2,1H3,(H,16,17)