1-[2-(5-decoxypyrimidin-2-yl)phenyl]nonan-1-one

Systemtic Name: 1-[2-(5-decoxypyrimidin-2-yl)phenyl]nonan-1-one Openeye Name: 1-[2-(5-decoxypyrimidin-2-yl)phenyl]nonan-1-one CAS Name: 1-[2-(5-decoxy-2-pyrimidinyl)phenyl]-1-nonanone IUPAC Name: 1-[2-(5-decoxypyrimidin-2-yl)phenyl]nonan-1-one Traditional Name: 1-[2-(5-decoxypyrimidin-2-yl)phenyl]nonan-1-one Formula: C29H44N2O2 MolecularWeight: 452.67186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CN=C(N=C1)C2=CC=CC=C2C(=O)CCCCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CN=C(N=C1)C2=CC=CC=C2C(=O)CCCCCCCC

InChI

InChI=1S/C29H44N2O2/c1-3-5-7-9-11-12-14-18-22-33-25-23-30-29(31-24-25)27-20-17-16-19-26(27)28(32)21-15-13-10-8-6-4-2/h16-17,19-20,23-24H,3-15,18,21-22H2,1-2H3