6-(4-phenylphenoxy)-N-undecyl-pyrimidin-4-amine

Systemtic Name: 6-(4-phenylphenoxy)-N-undecyl-pyrimidin-4-amine Openeye Name: 6-(4-phenylphenoxy)-N-undecyl-pyrimidin-4-amine CAS Name: 6-(4-phenylphenoxy)-N-undecyl-4-pyrimidinamine IUPAC Name: 6-(4-phenylphenoxy)-N-undecylpyrimidin-4-amine Traditional Name: [6-(4-phenylphenoxy)pyrimidin-4-yl]-undecyl-amine Formula: C27H35N3O MolecularWeight: 417.5863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCNC1=CC(=NC=N1)OC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCNC1=CC(=NC=N1)OC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H35N3O/c1-2-3-4-5-6-7-8-9-13-20-28-26-21-27(30-22-29-26)31-25-18-16-24(17-19-25)23-14-11-10-12-15-23/h10-12,14-19,21-22H,2-9,13,20H2,1H3,(H,28,29,30)