2-[2,6-dimethoxy-4-(oxan-2-yloxymethyl)phenyl]-1,10-phenanthroline

Systemtic Name: 2-[2,6-dimethoxy-4-(oxan-2-yloxymethyl)phenyl]-1,10-phenanthroline Openeye Name: 2-[2,6-dimethoxy-4-(tetrahydropyran-2-yloxymethyl)phenyl]-1,10-phenanthroline CAS Name: 2-[2,6-dimethoxy-4-(2-oxanyloxymethyl)phenyl]-1,10-phenanthroline IUPAC Name: 2-[2,6-dimethoxy-4-(oxan-2-yloxymethyl)phenyl]-1,10-phenanthroline Traditional Name: 2-[2,6-dimethoxy-4-(tetrahydropyran-2-yloxymethyl)phenyl]-1,10-phenanthroline Formula: C26H26N2O4 MolecularWeight: 430.49564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1C2=NC3=C(C=CC4=C3N=CC=C4)C=C2)OC)COC5CCCCO5

Isomeric SMILES

COC1=CC(=CC(=C1C2=NC3=C(C=CC4=C3N=CC=C4)C=C2)OC)COC5CCCCO5

InChI

InChI=1S/C26H26N2O4/c1-29-21-14-17(16-32-23-7-3-4-13-31-23)15-22(30-2)24(21)20-11-10-19-9-8-18-6-5-12-27-25(18)26(19)28-20/h5-6,8-12,14-15,23H,3-4,7,13,16H2,1-2H3