(2-carboxyphenyl)-(3,3-dimethylbut-1-ynyl)iodanium

Systemtic Name: (2-carboxyphenyl)-(3,3-dimethylbut-1-ynyl)iodanium Openeye Name: (2-carboxyphenyl)-(3,3-dimethylbut-1-ynyl)iodonium CAS Name: (2-carboxyphenyl)-(3,3-dimethylbut-1-ynyl)iodonium IUPAC Name: (2-carboxyphenyl)-(3,3-dimethylbut-1-ynyl)iodanium Traditional Name: (2-carboxyphenyl)-(3,3-dimethylbut-1-ynyl)iodonium Formula: C13H14IO2+ MolecularWeight: 329.15353

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#C[I+]C1=CC=CC=C1C(=O)O

Isomeric SMILES

CC(C)(C)C#C[I+]C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C13H13IO2/c1-13(2,3)8-9-14-11-7-5-4-6-10(11)12(15)16/h4-7H,1-3H3/p+1