tert-butyl 4-[3-(4-phenylmethoxypyrimidin-5-yl)propyl]benzoate

Systemtic Name: tert-butyl 4-[3-(4-phenylmethoxypyrimidin-5-yl)propyl]benzoate Openeye Name: tert-butyl 4-[3-(4-benzyloxypyrimidin-5-yl)propyl]benzoate CAS Name: 4-[3-(4-phenylmethoxy-5-pyrimidinyl)propyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(4-phenylmethoxypyrimidin-5-yl)propyl]benzoate Traditional Name: 4-[3-(4-benzoxypyrimidin-5-yl)propyl]benzoic acid tert-butyl ester Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)CCCC2=CN=CN=C2OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)CCCC2=CN=CN=C2OCC3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3/c1-25(2,3)30-24(28)21-14-12-19(13-15-21)10-7-11-22-16-26-18-27-23(22)29-17-20-8-5-4-6-9-20/h4-6,8-9,12-16,18H,7,10-11,17H2,1-3H3