methyl 2-[4-[5-(4-nonylphenyl)pyrimidin-2-yl]phenoxy]propanoate

Systemtic Name: methyl 2-[4-[5-(4-nonylphenyl)pyrimidin-2-yl]phenoxy]propanoate Openeye Name: methyl 2-[4-[5-(4-nonylphenyl)pyrimidin-2-yl]phenoxy]propanoate CAS Name: 2-[4-[5-(4-nonylphenyl)-2-pyrimidinyl]phenoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[4-[5-(4-nonylphenyl)pyrimidin-2-yl]phenoxy]propanoate Traditional Name: 2-[4-[5-(4-nonylphenyl)pyrimidin-2-yl]phenoxy]propionic acid methyl ester Formula: C29H36N2O3 MolecularWeight: 460.60774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)OC(C)C(=O)OC

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)OC(C)C(=O)OC

InChI

InChI=1S/C29H36N2O3/c1-4-5-6-7-8-9-10-11-23-12-14-24(15-13-23)26-20-30-28(31-21-26)25-16-18-27(19-17-25)34-22(2)29(32)33-3/h12-22H,4-11H2,1-3H3