[2-(4-hexanoyloxyphenyl)pyrimidin-5-yl] 2,2-dimethyl-1,3-dioxolane-4-carboxylate

Systemtic Name: [2-(4-hexanoyloxyphenyl)pyrimidin-5-yl] 2,2-dimethyl-1,3-dioxolane-4-carboxylate Openeye Name: [2-(4-hexanoyloxyphenyl)pyrimidin-5-yl] 2,2-dimethyl-1,3-dioxolane-4-carboxylate CAS Name: 2,2-dimethyl-1,3-dioxolane-4-carboxylic acid [2-[4-(1-oxohexoxy)phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-(4-hexanoyloxyphenyl)pyrimidin-5-yl] 2,2-dimethyl-1,3-dioxolane-4-carboxylate Traditional Name: 2,2-dimethyl-1,3-dioxolane-4-carboxylic acid [2-(4-caproyloxyphenyl)pyrimidin-5-yl] ester Formula: C22H26N2O6 MolecularWeight: 414.45164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)C3COC(O3)(C)C

Isomeric SMILES

CCCCCC(=O)OC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)C3COC(O3)(C)C

InChI

InChI=1S/C22H26N2O6/c1-4-5-6-7-19(25)28-16-10-8-15(9-11-16)20-23-12-17(13-24-20)29-21(26)18-14-27-22(2,3)30-18/h8-13,18H,4-7,14H2,1-3H3