3-[2-[5-chloranyl-2-(3-methylbutoxy)phenyl]phenyl]benzoic acid

Systemtic Name: 3-[2-[5-chloranyl-2-(3-methylbutoxy)phenyl]phenyl]benzoic acid Openeye Name: 3-[2-(5-chloro-2-isopentyloxy-phenyl)phenyl]benzoic acid CAS Name: 3-[2-[5-chloro-2-(3-methylbutoxy)phenyl]phenyl]benzoic acid IUPAC Name: 3-[2-[5-chloro-2-(3-methylbutoxy)phenyl]phenyl]benzoic acid Traditional Name: 3-[2-(5-chloro-2-isoamoxy-phenyl)phenyl]benzoic acid Formula: C24H23ClO3 MolecularWeight: 394.89062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)Cl)C2=CC=CC=C2C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)Cl)C2=CC=CC=C2C3=CC(=CC=C3)C(=O)O

InChI

InChI=1S/C24H23ClO3/c1-16(2)12-13-28-23-11-10-19(25)15-22(23)21-9-4-3-8-20(21)17-6-5-7-18(14-17)24(26)27/h3-11,14-16H,12-13H2,1-2H3,(H,26,27)