2-[5,6-bis(chloranyl)-3-oxidanylidene-1H-isoindol-2-yl]-3-cyclohexyl-propanoic acid

Systemtic Name: 2-[5,6-bis(chloranyl)-3-oxidanylidene-1H-isoindol-2-yl]-3-cyclohexyl-propanoic acid Openeye Name: 3-cyclohexyl-2-(5,6-dichloro-1-oxo-isoindolin-2-yl)propanoic acid CAS Name: 3-cyclohexyl-2-(5,6-dichloro-3-oxo-1H-isoindol-2-yl)propanoic acid IUPAC Name: 3-cyclohexyl-2-(5,6-dichloro-3-oxo-1H-isoindol-2-yl)propanoic acid Traditional Name: 3-cyclohexyl-2-(5,6-dichloro-1-keto-isoindolin-2-yl)propionic acid Formula: C17H19Cl2NO3 MolecularWeight: 356.24366

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)O)N2CC3=CC(=C(C=C3C2=O)Cl)Cl

Isomeric SMILES

C1CCC(CC1)CC(C(=O)O)N2CC3=CC(=C(C=C3C2=O)Cl)Cl

InChI

InChI=1S/C17H19Cl2NO3/c18-13-7-11-9-20(16(21)12(11)8-14(13)19)15(17(22)23)6-10-4-2-1-3-5-10/h7-8,10,15H,1-6,9H2,(H,22,23)