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

Systemtic Name: 5-[4-(7-phenyl-1,10-phenanthrolin-4-yl)phenyl]pentanoic acid Openeye Name: 5-[4-(7-phenyl-1,10-phenanthrolin-4-yl)phenyl]pentanoic acid CAS Name: 5-[4-(7-phenyl-1,10-phenanthrolin-4-yl)phenyl]pentanoic acid IUPAC Name: 5-[4-(7-phenyl-1,10-phenanthrolin-4-yl)phenyl]pentanoic acid Traditional Name: 5-[4-(7-phenyl-1,10-phenanthrolin-4-yl)phenyl]valeric acid Formula: C29H24N2O2 MolecularWeight: 432.51306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=C(C=C5)CCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=C(C=C5)CCCCC(=O)O

InChI

InChI=1S/C29H24N2O2/c32-27(33)9-5-4-6-20-10-12-22(13-11-20)24-17-19-31-29-26(24)15-14-25-23(16-18-30-28(25)29)21-7-2-1-3-8-21/h1-3,7-8,10-19H,4-6,9H2,(H,32,33)