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

Systemtic Name: [4-[5-(4-hexylphenyl)pyrimidin-2-yl]phenyl] 2,2-dimethyl-1,3-dioxolane-4-carboxylate Openeye Name: [4-[5-(4-hexylphenyl)pyrimidin-2-yl]phenyl] 2,2-dimethyl-1,3-dioxolane-4-carboxylate CAS Name: 2,2-dimethyl-1,3-dioxolane-4-carboxylic acid [4-[5-(4-hexylphenyl)-2-pyrimidinyl]phenyl] ester IUPAC Name: [4-[5-(4-hexylphenyl)pyrimidin-2-yl]phenyl] 2,2-dimethyl-1,3-dioxolane-4-carboxylate Traditional Name: 2,2-dimethyl-1,3-dioxolane-4-carboxylic acid [4-[5-(4-hexylphenyl)pyrimidin-2-yl]phenyl] ester Formula: C28H32N2O4 MolecularWeight: 460.56468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)OC(=O)C4COC(O4)(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=C(C=C3)OC(=O)C4COC(O4)(C)C

InChI

InChI=1S/C28H32N2O4/c1-4-5-6-7-8-20-9-11-21(12-10-20)23-17-29-26(30-18-23)22-13-15-24(16-14-22)33-27(31)25-19-32-28(2,3)34-25/h9-18,25H,4-8,19H2,1-3H3