3-[2-butyl-6,7-bis(chloranyl)-2-cyclopentyl-1-oxidanylidene-3H-inden-5-yl]propanoic acid

Systemtic Name: 3-[2-butyl-6,7-bis(chloranyl)-2-cyclopentyl-1-oxidanylidene-3H-inden-5-yl]propanoic acid Openeye Name: 3-(2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-indan-5-yl)propanoic acid CAS Name: 3-(2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-3H-inden-5-yl)propanoic acid IUPAC Name: 3-(2-butyl-6,7-dichloro-2-cyclopentyl-1-oxo-3H-inden-5-yl)propanoic acid Traditional Name: 3-(2-butyl-6,7-dichloro-2-cyclopentyl-1-keto-indan-5-yl)propionic acid Formula: C21H26Cl2O3 MolecularWeight: 397.33534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)CCC(=O)O)C3CCCC3

Isomeric SMILES

CCCCC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)CCC(=O)O)C3CCCC3

InChI

InChI=1S/C21H26Cl2O3/c1-2-3-10-21(15-6-4-5-7-15)12-14-11-13(8-9-16(24)25)18(22)19(23)17(14)20(21)26/h11,15H,2-10,12H2,1H3,(H,24,25)