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

Systemtic Name: 4-[[4-chloranyl-2-(2-methylcyclohexyl)-1-oxidanylidene-3H-isoindol-5-yl]oxy]butanoic acid Openeye Name: 4-[4-chloro-2-(2-methylcyclohexyl)-1-oxo-isoindolin-5-yl]oxybutanoic acid CAS Name: 4-[[4-chloro-2-(2-methylcyclohexyl)-1-oxo-3H-isoindol-5-yl]oxy]butanoic acid IUPAC Name: 4-[[4-chloro-2-(2-methylcyclohexyl)-1-oxo-3H-isoindol-5-yl]oxy]butanoic acid Traditional Name: 4-[4-chloro-1-keto-2-(2-methylcyclohexyl)isoindolin-5-yl]oxybutyric acid Formula: C19H24ClNO4 MolecularWeight: 365.85116

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1N2CC3=C(C2=O)C=CC(=C3Cl)OCCCC(=O)O

Isomeric SMILES

CC1CCCCC1N2CC3=C(C2=O)C=CC(=C3Cl)OCCCC(=O)O

InChI

InChI=1S/C19H24ClNO4/c1-12-5-2-3-6-15(12)21-11-14-13(19(21)24)8-9-16(18(14)20)25-10-4-7-17(22)23/h8-9,12,15H,2-7,10-11H2,1H3,(H,22,23)