2-chloranyl-4-[4-(4-hexylphenyl)phenyl]carbonyloxy-benzoic acid

Systemtic Name: 2-chloranyl-4-[4-(4-hexylphenyl)phenyl]carbonyloxy-benzoic acid Openeye Name: 2-chloro-4-[4-(4-hexylphenyl)benzoyl]oxy-benzoic acid CAS Name: 2-chloro-4-[[4-(4-hexylphenyl)phenyl]-oxomethoxy]benzoic acid IUPAC Name: 2-chloro-4-[4-(4-hexylphenyl)benzoyl]oxybenzoic acid Traditional Name: 2-chloro-4-[4-(4-hexylphenyl)benzoyl]oxy-benzoic acid Formula: C26H25ClO4 MolecularWeight: 436.9273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC(=C(C=C3)C(=O)O)Cl

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC(=C(C=C3)C(=O)O)Cl

InChI

InChI=1S/C26H25ClO4/c1-2-3-4-5-6-18-7-9-19(10-8-18)20-11-13-21(14-12-20)26(30)31-22-15-16-23(25(28)29)24(27)17-22/h7-17H,2-6H2,1H3,(H,28,29)