decyl 4-[2-(4-phenylmethoxyphenyl)pyrimidin-5-yl]benzoate

Systemtic Name: decyl 4-[2-(4-phenylmethoxyphenyl)pyrimidin-5-yl]benzoate Openeye Name: decyl 4-[2-(4-benzyloxyphenyl)pyrimidin-5-yl]benzoate CAS Name: 4-[2-(4-phenylmethoxyphenyl)-5-pyrimidinyl]benzoic acid decyl ester IUPAC Name: decyl 4-[2-(4-phenylmethoxyphenyl)pyrimidin-5-yl]benzoate Traditional Name: 4-[2-(4-benzoxyphenyl)pyrimidin-5-yl]benzoic acid decyl ester Formula: C34H38N2O3 MolecularWeight: 522.67712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)C1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCOC(=O)C1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C34H38N2O3/c1-2-3-4-5-6-7-8-12-23-38-34(37)30-17-15-28(16-18-30)31-24-35-33(36-25-31)29-19-21-32(22-20-29)39-26-27-13-10-9-11-14-27/h9-11,13-22,24-25H,2-8,12,23,26H2,1H3