2-iodosyl-3,5,6-triphenyl-naphthalene-1-carboxylic acid

Systemtic Name: 2-iodosyl-3,5,6-triphenyl-naphthalene-1-carboxylic acid Openeye Name: 2-iodosyl-3,5,6-triphenyl-naphthalene-1-carboxylic acid CAS Name: 2-iodosyl-3,5,6-triphenyl-1-naphthalenecarboxylic acid IUPAC Name: 2-iodosyl-3,5,6-triphenylnaphthalene-1-carboxylic acid Traditional Name: 2-iodosyl-3,5,6-triphenyl-1-naphthoic acid Formula: C29H19IO3 MolecularWeight: 542.36383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=CC(=C(C(=C3C=C2)C(=O)O)I=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=CC(=C(C(=C3C=C2)C(=O)O)I=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H19IO3/c31-29(32)27-23-17-16-22(19-10-4-1-5-11-19)26(21-14-8-3-9-15-21)25(23)18-24(28(27)30-33)20-12-6-2-7-13-20/h1-18H,(H,31,32)