3-heptoxy-8-(6-methyloctoxy)-4,7-phenanthroline

Systemtic Name: 3-heptoxy-8-(6-methyloctoxy)-4,7-phenanthroline Openeye Name: 3-heptoxy-8-(6-methyloctoxy)-4,7-phenanthroline CAS Name: 3-heptoxy-8-(6-methyloctoxy)-4,7-phenanthroline IUPAC Name: 3-heptoxy-8-(6-methyloctoxy)-4,7-phenanthroline Traditional Name: 3-heptoxy-8-(6-methyloctoxy)-4,7-phenanthroline Formula: C28H40N2O2 MolecularWeight: 436.6294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=NC2=C(C=C1)C3=C(C=C2)N=C(C=C3)OCCCCCC(C)CC

Isomeric SMILES

CCCCCCCOC1=NC2=C(C=C1)C3=C(C=C2)N=C(C=C3)OCCCCCC(C)CC

InChI

InChI=1S/C28H40N2O2/c1-4-6-7-8-11-20-31-27-18-14-23-24-15-19-28(30-26(24)17-16-25(23)29-27)32-21-12-9-10-13-22(3)5-2/h14-19,22H,4-13,20-21H2,1-3H3