5-[4-(5-octoxypyrimidin-2-yl)phenoxy]pentan-2-yl heptanoate

Systemtic Name: 5-[4-(5-octoxypyrimidin-2-yl)phenoxy]pentan-2-yl heptanoate Openeye Name: [1-methyl-4-[4-(5-octoxypyrimidin-2-yl)phenoxy]butyl] heptanoate CAS Name: heptanoic acid 5-[4-(5-octoxy-2-pyrimidinyl)phenoxy]pentan-2-yl ester IUPAC Name: 5-[4-(5-octoxypyrimidin-2-yl)phenoxy]pentan-2-yl heptanoate Traditional Name: enanthic acid [1-methyl-4-[4-(5-octoxypyrimidin-2-yl)phenoxy]butyl] ester Formula: C30H46N2O4 MolecularWeight: 498.69724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCC(C)OC(=O)CCCCCC

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OCCCC(C)OC(=O)CCCCCC

InChI

InChI=1S/C30H46N2O4/c1-4-6-8-10-11-13-21-35-28-23-31-30(32-24-28)26-17-19-27(20-18-26)34-22-14-15-25(3)36-29(33)16-12-9-7-5-2/h17-20,23-25H,4-16,21-22H2,1-3H3