2-[4-(3-butyloxiran-2-yl)oxy-3-methyl-phenyl]-5-(4-hexylphenyl)pyrimidine

Systemtic Name: 2-[4-(3-butyloxiran-2-yl)oxy-3-methyl-phenyl]-5-(4-hexylphenyl)pyrimidine Openeye Name: 2-[4-(3-butyloxiran-2-yl)oxy-3-methyl-phenyl]-5-(4-hexylphenyl)pyrimidine CAS Name: 2-[4-[(3-butyl-2-oxiranyl)oxy]-3-methylphenyl]-5-(4-hexylphenyl)pyrimidine IUPAC Name: 2-[4-(3-butyloxiran-2-yl)oxy-3-methylphenyl]-5-(4-hexylphenyl)pyrimidine Traditional Name: 2-[4-(3-butyloxiran-2-yl)oxy-3-methyl-phenyl]-5-(4-hexylphenyl)pyrimidine Formula: C29H36N2O2 MolecularWeight: 444.60834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC(=C(C=C3)OC4C(O4)CCCC)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC(=C(C=C3)OC4C(O4)CCCC)C

InChI

InChI=1S/C29H36N2O2/c1-4-6-8-9-10-22-12-14-23(15-13-22)25-19-30-28(31-20-25)24-16-17-26(21(3)18-24)32-29-27(33-29)11-7-5-2/h12-20,27,29H,4-11H2,1-3H3