4-[3-[[6,7-bis(chloranyl)-2-cyclopentyl-1-oxidanylidene-2,3-dihydroinden-5-yl]oxymethyl]phenyl]benzoic acid

Systemtic Name: 4-[3-[[6,7-bis(chloranyl)-2-cyclopentyl-1-oxidanylidene-2,3-dihydroinden-5-yl]oxymethyl]phenyl]benzoic acid Openeye Name: 4-[3-[(6,7-dichloro-2-cyclopentyl-1-oxo-indan-5-yl)oxymethyl]phenyl]benzoic acid CAS Name: 4-[3-[(6,7-dichloro-2-cyclopentyl-1-oxo-2,3-dihydroinden-5-yl)oxymethyl]phenyl]benzoic acid IUPAC Name: 4-[3-[(6,7-dichloro-2-cyclopentyl-1-oxo-2,3-dihydroinden-5-yl)oxymethyl]phenyl]benzoic acid Traditional Name: 4-[3-[(6,7-dichloro-2-cyclopentyl-1-keto-indan-5-yl)oxymethyl]phenyl]benzoic acid Formula: C28H24Cl2O4 MolecularWeight: 495.39376

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2CC3=CC(=C(C(=C3C2=O)Cl)Cl)OCC4=CC=CC(=C4)C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1CCC(C1)C2CC3=CC(=C(C(=C3C2=O)Cl)Cl)OCC4=CC=CC(=C4)C5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C28H24Cl2O4/c29-25-23(14-21-13-22(18-5-1-2-6-18)27(31)24(21)26(25)30)34-15-16-4-3-7-20(12-16)17-8-10-19(11-9-17)28(32)33/h3-4,7-12,14,18,22H,1-2,5-6,13,15H2,(H,32,33)