4-[2-[4-(bromomethyl)-3-propan-2-yl-phenyl]ethynyl]benzoic acid

Systemtic Name: 4-[2-[4-(bromomethyl)-3-propan-2-yl-phenyl]ethynyl]benzoic acid Openeye Name: 4-[2-[4-(bromomethyl)-3-isopropyl-phenyl]ethynyl]benzoic acid CAS Name: 4-[2-[4-(bromomethyl)-3-propan-2-ylphenyl]ethynyl]benzoic acid IUPAC Name: 4-[2-[4-(bromomethyl)-3-propan-2-ylphenyl]ethynyl]benzoic acid Traditional Name: 4-[2-[4-(bromomethyl)-3-isopropyl-phenyl]ethynyl]benzoic acid Formula: C19H17BrO2 MolecularWeight: 357.24108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)C#CC2=CC=C(C=C2)C(=O)O)CBr

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)C#CC2=CC=C(C=C2)C(=O)O)CBr

InChI

InChI=1S/C19H17BrO2/c1-13(2)18-11-15(7-10-17(18)12-20)4-3-14-5-8-16(9-6-14)19(21)22/h5-11,13H,12H2,1-2H3,(H,21,22)