4-[1-(4-chlorophenyl)hexoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[1-(4-chlorophenyl)hexoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[1-(4-chlorophenyl)hexoxy]-4-oxo-butanoic acid CAS Name: 4-[1-(4-chlorophenyl)hexoxy]-4-oxobutanoic acid IUPAC Name: 4-[1-(4-chlorophenyl)hexoxy]-4-oxobutanoic acid Traditional Name: 4-[1-(4-chlorophenyl)hexoxy]-4-keto-butyric acid Formula: C16H21ClO4 MolecularWeight: 312.78854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=C(C=C1)Cl)OC(=O)CCC(=O)O

Isomeric SMILES

CCCCCC(C1=CC=C(C=C1)Cl)OC(=O)CCC(=O)O

InChI

InChI=1S/C16H21ClO4/c1-2-3-4-5-14(12-6-8-13(17)9-7-12)21-16(20)11-10-15(18)19/h6-9,14H,2-5,10-11H2,1H3,(H,18,19)