4-[2-[2-[(2-methylpropan-2-yl)oxy]phenyl]ethynyl]benzoic acid

Systemtic Name: 4-[2-[2-[(2-methylpropan-2-yl)oxy]phenyl]ethynyl]benzoic acid Openeye Name: 4-[2-(2-tert-butoxyphenyl)ethynyl]benzoic acid CAS Name: 4-[2-[2-[(2-methylpropan-2-yl)oxy]phenyl]ethynyl]benzoic acid IUPAC Name: 4-[2-[2-[(2-methylpropan-2-yl)oxy]phenyl]ethynyl]benzoic acid Traditional Name: 4-[2-(2-tert-butoxyphenyl)ethynyl]benzoic acid Formula: C19H18O3 MolecularWeight: 294.34442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC=CC=C1C#CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC1=CC=CC=C1C#CC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C19H18O3/c1-19(2,3)22-17-7-5-4-6-15(17)11-8-14-9-12-16(13-10-14)18(20)21/h4-7,9-10,12-13H,1-3H3,(H,20,21)