[4-(5-butylpyrimidin-2-yl)phenyl] 2-methyl-3-pentoxy-propanoate

Systemtic Name: [4-(5-butylpyrimidin-2-yl)phenyl] 2-methyl-3-pentoxy-propanoate Openeye Name: [4-(5-butylpyrimidin-2-yl)phenyl] 2-methyl-3-pentoxy-propanoate CAS Name: 2-methyl-3-pentoxypropanoic acid [4-(5-butyl-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-butylpyrimidin-2-yl)phenyl] 2-methyl-3-pentoxypropanoate Traditional Name: 3-amoxy-2-methyl-propionic acid [4-(5-butylpyrimidin-2-yl)phenyl] ester Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOCC(C)C(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)CCCC

Isomeric SMILES

CCCCCOCC(C)C(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)CCCC

InChI

InChI=1S/C23H32N2O3/c1-4-6-8-14-27-17-18(3)23(26)28-21-12-10-20(11-13-21)22-24-15-19(16-25-22)9-7-5-2/h10-13,15-16,18H,4-9,14,17H2,1-3H3