2-chloranyl-4-[2-(3-chloranyl-4-oxidanyl-phenyl)propan-2-yl]phenol trihydrate

Systemtic Name: 2-chloranyl-4-[2-(3-chloranyl-4-oxidanyl-phenyl)propan-2-yl]phenol trihydrate Openeye Name: 2-chloro-4-[1-(3-chloro-4-hydroxy-phenyl)-1-methyl-ethyl]phenol trihydrate CAS Name: 2-chloro-4-[2-(3-chloro-4-hydroxyphenyl)propan-2-yl]phenol trihydrate IUPAC Name: 2-chloro-4-[2-(3-chloro-4-hydroxyphenyl)propan-2-yl]phenol trihydrate Traditional Name: 2-chloro-4-[1-(3-chloro-4-hydroxy-phenyl)-1-methyl-ethyl]phenol trihydrate Formula: C15H20Cl2O5 MolecularWeight: 351.2223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC(=C(C=C1)O)Cl)C2=CC(=C(C=C2)O)Cl.O.O.O

Isomeric SMILES

CC(C)(C1=CC(=C(C=C1)O)Cl)C2=CC(=C(C=C2)O)Cl.O.O.O

InChI

InChI=1S/C15H14Cl2O2.3H2O/c1-15(2,9-3-5-13(18)11(16)7-9)10-4-6-14(19)12(17)8-10;;;/h3-8,18-19H,1-2H3;3*1H2