2-[4-(4-butoxybutoxy)phenyl]-5-(6-cyclopropylhexoxy)pyrimidine

Systemtic Name: 2-[4-(4-butoxybutoxy)phenyl]-5-(6-cyclopropylhexoxy)pyrimidine Openeye Name: 2-[4-(4-butoxybutoxy)phenyl]-5-(6-cyclopropylhexoxy)pyrimidine CAS Name: 2-[4-(4-butoxybutoxy)phenyl]-5-(6-cyclopropylhexoxy)pyrimidine IUPAC Name: 2-[4-(4-butoxybutoxy)phenyl]-5-(6-cyclopropylhexoxy)pyrimidine Traditional Name: 2-[4-(4-butoxybutoxy)phenyl]-5-(6-cyclopropylhexoxy)pyrimidine Formula: C27H40N2O3 MolecularWeight: 440.6181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCCC3CC3

Isomeric SMILES

CCCCOCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)OCCCCCCC3CC3

InChI

InChI=1S/C27H40N2O3/c1-2-3-17-30-18-8-9-20-31-25-15-13-24(14-16-25)27-28-21-26(22-29-27)32-19-7-5-4-6-10-23-11-12-23/h13-16,21-23H,2-12,17-20H2,1H3