5-octoxy-2-[4-[2-(oxiran-2-yl)propoxy]phenyl]pyrimidine

Systemtic Name: 5-octoxy-2-[4-[2-(oxiran-2-yl)propoxy]phenyl]pyrimidine Openeye Name: 5-octoxy-2-[4-[2-(oxiran-2-yl)propoxy]phenyl]pyrimidine CAS Name: 5-octoxy-2-[4-[2-(2-oxiranyl)propoxy]phenyl]pyrimidine IUPAC Name: 5-octoxy-2-[4-[2-(oxiran-2-yl)propoxy]phenyl]pyrimidine Traditional Name: 5-octoxy-2-[4-[2-(oxiran-2-yl)propoxy]phenyl]pyrimidine Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(C)C3CO3

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OCC(C)C3CO3

InChI

InChI=1S/C23H32N2O3/c1-3-4-5-6-7-8-13-26-21-14-24-23(25-15-21)19-9-11-20(12-10-19)27-16-18(2)22-17-28-22/h9-12,14-15,18,22H,3-8,13,16-17H2,1-2H3