4-[(2-butyl-6-chloranyl-1-oxidanylidene-3H-isoindol-5-yl)oxy]butanoic acid

Systemtic Name: 4-[(2-butyl-6-chloranyl-1-oxidanylidene-3H-isoindol-5-yl)oxy]butanoic acid Openeye Name: 4-(2-butyl-6-chloro-1-oxo-isoindolin-5-yl)oxybutanoic acid CAS Name: 4-[(2-butyl-6-chloro-1-oxo-3H-isoindol-5-yl)oxy]butanoic acid IUPAC Name: 4-[(2-butyl-6-chloro-1-oxo-3H-isoindol-5-yl)oxy]butanoic acid Traditional Name: 4-(2-butyl-6-chloro-1-keto-isoindolin-5-yl)oxybutyric acid Formula: C16H20ClNO4 MolecularWeight: 325.7873

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC2=CC(=C(C=C2C1=O)Cl)OCCCC(=O)O

Isomeric SMILES

CCCCN1CC2=CC(=C(C=C2C1=O)Cl)OCCCC(=O)O

InChI

InChI=1S/C16H20ClNO4/c1-2-3-6-18-10-11-8-14(22-7-4-5-15(19)20)13(17)9-12(11)16(18)21/h8-9H,2-7,10H2,1H3,(H,19,20)