2-[4-(3-butoxybutyl)phenyl]-5-decoxy-pyrimidine

Systemtic Name: 2-[4-(3-butoxybutyl)phenyl]-5-decoxy-pyrimidine Openeye Name: 2-[4-(3-butoxybutyl)phenyl]-5-decoxy-pyrimidine CAS Name: 2-[4-(3-butoxybutyl)phenyl]-5-decoxypyrimidine IUPAC Name: 2-[4-(3-butoxybutyl)phenyl]-5-decoxypyrimidine Traditional Name: 2-[4-(3-butoxybutyl)phenyl]-5-decoxy-pyrimidine Formula: C28H44N2O2 MolecularWeight: 440.66116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCC(C)OCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)CCC(C)OCCCC

InChI

InChI=1S/C28H44N2O2/c1-4-6-8-9-10-11-12-13-21-32-27-22-29-28(30-23-27)26-18-16-25(17-19-26)15-14-24(3)31-20-7-5-2/h16-19,22-24H,4-15,20-21H2,1-3H3