(7,12-diphenylbenzo[k]fluoranthen-3-yl)boronic acid

Systemtic Name: (7,12-diphenylbenzo[k]fluoranthen-3-yl)boronic acid Openeye Name: (7,12-diphenylbenzo[k]fluoranthen-3-yl)boronic acid CAS Name: (7,12-diphenyl-3-benzo[k]fluoranthenyl)boronic acid IUPAC Name: (7,12-diphenylbenzo[k]fluoranthen-3-yl)boronic acid Traditional Name: (7,12-diphenylbenzo[k]fluoranthen-3-yl)boronic acid Formula: C32H21BO2 MolecularWeight: 448.31894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=C2C=CC=C3C2=C(C=C1)C4=C(C5=CC=CC=C5C(=C34)C6=CC=CC=C6)C7=CC=CC=C7)(O)O

Isomeric SMILES

B(C1=C2C=CC=C3C2=C(C=C1)C4=C(C5=CC=CC=C5C(=C34)C6=CC=CC=C6)C7=CC=CC=C7)(O)O

InChI

InChI=1S/C32H21BO2/c34-33(35)27-19-18-26-30-24(27)16-9-17-25(30)31-28(20-10-3-1-4-11-20)22-14-7-8-15-23(22)29(32(26)31)21-12-5-2-6-13-21/h1-19,34-35H