[4-[4-(5-decylpyrimidin-2-yl)phenyl]-2,2-dimethyl-1,3-dioxolan-4-yl] hydrogen carbonate

Systemtic Name: [4-[4-(5-decylpyrimidin-2-yl)phenyl]-2,2-dimethyl-1,3-dioxolan-4-yl] hydrogen carbonate Openeye Name: [4-[4-(5-decylpyrimidin-2-yl)phenyl]-2,2-dimethyl-1,3-dioxolan-4-yl] hydrogen carbonate CAS Name: carbonic acid [4-[4-(5-decyl-2-pyrimidinyl)phenyl]-2,2-dimethyl-1,3-dioxolan-4-yl] ester IUPAC Name: [4-[4-(5-decylpyrimidin-2-yl)phenyl]-2,2-dimethyl-1,3-dioxolan-4-yl] hydrogen carbonate Traditional Name: carbonic acid [4-[4-(5-decylpyrimidin-2-yl)phenyl]-2,2-dimethyl-1,3-dioxolan-4-yl] ester Formula: C26H36N2O5 MolecularWeight: 456.57444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3(COC(O3)(C)C)OC(=O)O

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C3(COC(O3)(C)C)OC(=O)O

InChI

InChI=1S/C26H36N2O5/c1-4-5-6-7-8-9-10-11-12-20-17-27-23(28-18-20)21-13-15-22(16-14-21)26(32-24(29)30)19-31-25(2,3)33-26/h13-18H,4-12,19H2,1-3H3,(H,29,30)