3-decoxy-8-hexoxy-4,7-phenanthroline

Systemtic Name: 3-decoxy-8-hexoxy-4,7-phenanthroline Openeye Name: 3-decoxy-8-hexoxy-4,7-phenanthroline CAS Name: 3-decoxy-8-hexoxy-4,7-phenanthroline IUPAC Name: 3-decoxy-8-hexoxy-4,7-phenanthroline Traditional Name: 3-decoxy-8-hexoxy-4,7-phenanthroline Formula: C28H40N2O2 MolecularWeight: 436.6294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=NC2=C(C=C1)C3=C(C=C2)N=C(C=C3)OCCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=NC2=C(C=C1)C3=C(C=C2)N=C(C=C3)OCCCCCC

InChI

InChI=1S/C28H40N2O2/c1-3-5-7-9-10-11-12-14-22-32-28-20-16-24-23-15-19-27(31-21-13-8-6-4-2)29-25(23)17-18-26(24)30-28/h15-20H,3-14,21-22H2,1-2H3