4-[[(4-carboxyphenyl)-(4-dodecoxyphenyl)methoxy]-(4-dodecoxyphenyl)methyl]benzoic acid

Systemtic Name: 4-[[(4-carboxyphenyl)-(4-dodecoxyphenyl)methoxy]-(4-dodecoxyphenyl)methyl]benzoic acid Openeye Name: 4-[[(4-carboxyphenyl)-(4-dodecoxyphenyl)methoxy]-(4-dodecoxyphenyl)methyl]benzoic acid CAS Name: 4-[[(4-carboxyphenyl)-(4-dodecoxyphenyl)methoxy]-(4-dodecoxyphenyl)methyl]benzoic acid IUPAC Name: 4-[[(4-carboxyphenyl)-(4-dodecoxyphenyl)methoxy]-(4-dodecoxyphenyl)methyl]benzoic acid Traditional Name: 4-[[(4-carboxyphenyl)-(4-lauryloxyphenyl)methoxy]-(4-lauryloxyphenyl)methyl]benzoic acid Formula: C52H70O7 MolecularWeight: 807.108

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)C(=O)O)OC(C3=CC=C(C=C3)C(=O)O)C4=CC=C(C=C4)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)C(=O)O)OC(C3=CC=C(C=C3)C(=O)O)C4=CC=C(C=C4)OCCCCCCCCCCCC

InChI

InChI=1S/C52H70O7/c1-3-5-7-9-11-13-15-17-19-21-39-57-47-35-31-43(32-36-47)49(41-23-27-45(28-24-41)51(53)54)59-50(42-25-29-46(30-26-42)52(55)56)44-33-37-48(38-34-44)58-40-22-20-18-16-14-12-10-8-6-4-2/h23-38,49-50H,3-22,39-40H2,1-2H3,(H,53,54)(H,55,56)