5-[2-(4-phenylbenzo[b][1,10]phenanthrolin-7-yl)phenyl]pentanoic acid

Systemtic Name: 5-[2-(4-phenylbenzo[b][1,10]phenanthrolin-7-yl)phenyl]pentanoic acid Openeye Name: 5-[2-(4-phenylbenzo[b][1,10]phenanthrolin-7-yl)phenyl]pentanoic acid CAS Name: 5-[2-(4-phenyl-7-benzo[b][1,10]phenanthrolinyl)phenyl]pentanoic acid IUPAC Name: 5-[2-(4-phenylbenzo[b][1,10]phenanthrolin-7-yl)phenyl]pentanoic acid Traditional Name: 5-[2-(4-phenylbenzo[b][1,10]phenanthrolin-7-yl)phenyl]valeric acid Formula: C33H26N2O2 MolecularWeight: 482.57174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC4=C(C5=CC=CC=C5N=C4C3=NC=C2)C6=CC=CC=C6CCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC4=C(C5=CC=CC=C5N=C4C3=NC=C2)C6=CC=CC=C6CCCCC(=O)O

InChI

InChI=1S/C33H26N2O2/c36-30(37)17-9-5-13-23-12-4-6-14-25(23)31-27-15-7-8-16-29(27)35-33-28(31)19-18-26-24(20-21-34-32(26)33)22-10-2-1-3-11-22/h1-4,6-8,10-12,14-16,18-21H,5,9,13,17H2,(H,36,37)