1-[4-[2-(4-butoxyphenyl)pyrimidin-5-yl]phenoxy]propyl 2-butoxypropanoate

Systemtic Name: 1-[4-[2-(4-butoxyphenyl)pyrimidin-5-yl]phenoxy]propyl 2-butoxypropanoate Openeye Name: 1-[4-[2-(4-butoxyphenyl)pyrimidin-5-yl]phenoxy]propyl 2-butoxypropanoate CAS Name: 2-butoxypropanoic acid 1-[4-[2-(4-butoxyphenyl)-5-pyrimidinyl]phenoxy]propyl ester IUPAC Name: 1-[4-[2-(4-butoxyphenyl)pyrimidin-5-yl]phenoxy]propyl 2-butoxypropanoate Traditional Name: 2-butoxypropionic acid 1-[4-[2-(4-butoxyphenyl)pyrimidin-5-yl]phenoxy]propyl ester Formula: C30H38N2O5 MolecularWeight: 506.63312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(CC)OC(=O)C(C)OCCCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(CC)OC(=O)C(C)OCCCC

InChI

InChI=1S/C30H38N2O5/c1-5-8-18-34-22(4)30(33)37-28(7-3)36-27-16-10-23(11-17-27)25-20-31-29(32-21-25)24-12-14-26(15-13-24)35-19-9-6-2/h10-17,20-22,28H,5-9,18-19H2,1-4H3