4-[4-[2-[4-(2-butoxyethoxy)phenyl]ethynyl]phenyl]benzoic acid

Systemtic Name: 4-[4-[2-[4-(2-butoxyethoxy)phenyl]ethynyl]phenyl]benzoic acid Openeye Name: 4-[4-[2-[4-(2-butoxyethoxy)phenyl]ethynyl]phenyl]benzoic acid CAS Name: 4-[4-[2-[4-(2-butoxyethoxy)phenyl]ethynyl]phenyl]benzoic acid IUPAC Name: 4-[4-[2-[4-(2-butoxyethoxy)phenyl]ethynyl]phenyl]benzoic acid Traditional Name: 4-[4-[2-[4-(2-butoxyethoxy)phenyl]ethynyl]phenyl]benzoic acid Formula: C27H26O4 MolecularWeight: 414.49294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C27H26O4/c1-2-3-18-30-19-20-31-26-16-8-22(9-17-26)5-4-21-6-10-23(11-7-21)24-12-14-25(15-13-24)27(28)29/h6-17H,2-3,18-20H2,1H3,(H,28,29)