5-nonyl-1,10-phenanthroline-4-carboxylate

Systemtic Name: 5-nonyl-1,10-phenanthroline-4-carboxylate Openeye Name: 5-nonyl-1,10-phenanthroline-4-carboxylate CAS Name: 5-nonyl-1,10-phenanthroline-4-carboxylate IUPAC Name: 5-nonyl-1,10-phenanthroline-4-carboxylate Traditional Name: 5-nonyl-1,10-phenanthroline-4-carboxylate Formula: C22H25N2O2- MolecularWeight: 349.4461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC2=C(C3=NC=CC(=C13)C(=O)[O-])N=CC=C2

Isomeric SMILES

CCCCCCCCCC1=CC2=C(C3=NC=CC(=C13)C(=O)[O-])N=CC=C2

InChI

InChI=1S/C22H26N2O2/c1-2-3-4-5-6-7-8-10-16-15-17-11-9-13-23-20(17)21-19(16)18(22(25)26)12-14-24-21/h9,11-15H,2-8,10H2,1H3,(H,25,26)/p-1