5-(3-chloranyl-4,5-dimethoxy-phenyl)pentanoic acid

Systemtic Name: 5-(3-chloranyl-4,5-dimethoxy-phenyl)pentanoic acid Openeye Name: 5-(3-chloro-4,5-dimethoxy-phenyl)pentanoic acid CAS Name: 5-(3-chloro-4,5-dimethoxyphenyl)pentanoic acid IUPAC Name: 5-(3-chloro-4,5-dimethoxyphenyl)pentanoic acid Traditional Name: 5-(3-chloro-4,5-dimethoxy-phenyl)valeric acid Formula: C13H17ClO4 MolecularWeight: 272.72468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CCCCC(=O)O)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CCCCC(=O)O)Cl)OC

InChI

InChI=1S/C13H17ClO4/c1-17-11-8-9(5-3-4-6-12(15)16)7-10(14)13(11)18-2/h7-8H,3-6H2,1-2H3,(H,15,16)