2,2-bis[2-[(4-chlorophenyl)-oxidanyl-methyl]phenoxy]butanoic acid

Systemtic Name: 2,2-bis[2-[(4-chlorophenyl)-oxidanyl-methyl]phenoxy]butanoic acid Openeye Name: 2,2-bis[2-[(4-chlorophenyl)-hydroxy-methyl]phenoxy]butanoic acid CAS Name: 2,2-bis[2-[(4-chlorophenyl)-hydroxymethyl]phenoxy]butanoic acid IUPAC Name: 2,2-bis[2-[(4-chlorophenyl)-hydroxymethyl]phenoxy]butanoic acid Traditional Name: 2,2-bis[2-[(4-chlorophenyl)-hydroxy-methyl]phenoxy]butyric acid Formula: C30H26Cl2O6 MolecularWeight: 553.42984

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)(OC1=CC=CC=C1C(C2=CC=C(C=C2)Cl)O)OC3=CC=CC=C3C(C4=CC=C(C=C4)Cl)O

Isomeric SMILES

CCC(C(=O)O)(OC1=CC=CC=C1C(C2=CC=C(C=C2)Cl)O)OC3=CC=CC=C3C(C4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C30H26Cl2O6/c1-2-30(29(35)36,37-25-9-5-3-7-23(25)27(33)19-11-15-21(31)16-12-19)38-26-10-6-4-8-24(26)28(34)20-13-17-22(32)18-14-20/h3-18,27-28,33-34H,2H2,1H3,(H,35,36)