4-[4-chloranyl-2-(phenylmethyl)phenoxy]butanoic acid

Systemtic Name: 4-[4-chloranyl-2-(phenylmethyl)phenoxy]butanoic acid Openeye Name: 4-(2-benzyl-4-chloro-phenoxy)butanoic acid CAS Name: 4-[4-chloro-2-(phenylmethyl)phenoxy]butanoic acid IUPAC Name: 4-(2-benzyl-4-chlorophenoxy)butanoic acid Traditional Name: 4-(2-benzyl-4-chloro-phenoxy)butyric acid Formula: C17H17ClO3 MolecularWeight: 304.76808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)OCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)OCCCC(=O)O

InChI

InChI=1S/C17H17ClO3/c18-15-8-9-16(21-10-4-7-17(19)20)14(12-15)11-13-5-2-1-3-6-13/h1-3,5-6,8-9,12H,4,7,10-11H2,(H,19,20)