2-[2-(5-methylheptoxy)phenyl]-4-octyl-pyrimidine

Systemtic Name: 2-[2-(5-methylheptoxy)phenyl]-4-octyl-pyrimidine Openeye Name: 2-[2-(5-methylheptoxy)phenyl]-4-octyl-pyrimidine CAS Name: 2-[2-(5-methylheptoxy)phenyl]-4-octylpyrimidine IUPAC Name: 2-[2-(5-methylheptoxy)phenyl]-4-octylpyrimidine Traditional Name: 2-[2-(5-methylheptoxy)phenyl]-4-octyl-pyrimidine Formula: C26H40N2O MolecularWeight: 396.6086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NC(=NC=C1)C2=CC=CC=C2OCCCCC(C)CC

Isomeric SMILES

CCCCCCCCC1=NC(=NC=C1)C2=CC=CC=C2OCCCCC(C)CC

InChI

InChI=1S/C26H40N2O/c1-4-6-7-8-9-10-16-23-19-20-27-26(28-23)24-17-11-12-18-25(24)29-21-14-13-15-22(3)5-2/h11-12,17-20,22H,4-10,13-16,21H2,1-3H3