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2,3-bis(2-chloranyl-5-propyl-phenyl)terephthalic acid

2,3-bis(2-chloranyl-5-propyl-phenyl)terephthalic acid

Systemtic Name:2,3-bis(2-chloranyl-5-propyl-phenyl)terephthalic acid
Openeye Name:2,3-bis(2-chloro-5-propyl-phenyl)terephthalic acid
CAS Name:2,3-bis(2-chloro-5-propylphenyl)terephthalic acid
IUPAC Name:2,3-bis(2-chloro-5-propylphenyl)terephthalic acid
Traditional Name:2,3-bis(2-chloro-5-propyl-phenyl)terephthalic acid
Formula: C26H24Cl2O4
MolecularWeight: 471.37236
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)Cl)C2=C(C=CC(=C2C3=C(C=CC(=C3)CCC)Cl)C(=O)O)C(=O)O


Isomeric SMILES

CCCC1=CC(=C(C=C1)Cl)C2=C(C=CC(=C2C3=C(C=CC(=C3)CCC)Cl)C(=O)O)C(=O)O


InChI

InChI=1S/C26H24Cl2O4/c1-3-5-15-7-11-21(27)19(13-15)23-17(25(29)30)9-10-18(26(31)32)24(23)20-14-16(6-4-2)8-12-22(20)28/h7-14H,3-6H2,1-2H3,(H,29,30)(H,31,32)


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