butyl 2-[4-[2-(4-butylphenyl)pyrimidin-5-yl]phenoxy]propanoate

Systemtic Name: butyl 2-[4-[2-(4-butylphenyl)pyrimidin-5-yl]phenoxy]propanoate Openeye Name: butyl 2-[4-[2-(4-butylphenyl)pyrimidin-5-yl]phenoxy]propanoate CAS Name: 2-[4-[2-(4-butylphenyl)-5-pyrimidinyl]phenoxy]propanoic acid butyl ester IUPAC Name: butyl 2-[4-[2-(4-butylphenyl)pyrimidin-5-yl]phenoxy]propanoate Traditional Name: 2-[4-[2-(4-butylphenyl)pyrimidin-5-yl]phenoxy]propionic acid butyl ester Formula: C27H32N2O3 MolecularWeight: 432.55458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(C)C(=O)OCCCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OC(C)C(=O)OCCCC

InChI

InChI=1S/C27H32N2O3/c1-4-6-8-21-9-11-23(12-10-21)26-28-18-24(19-29-26)22-13-15-25(16-14-22)32-20(3)27(30)31-17-7-5-2/h9-16,18-20H,4-8,17H2,1-3H3