6-methyl-1-[2-(4-pentylpyridin-2-yl)phenyl]octan-1-one

Systemtic Name: 6-methyl-1-[2-(4-pentylpyridin-2-yl)phenyl]octan-1-one Openeye Name: 6-methyl-1-[2-(4-pentyl-2-pyridyl)phenyl]octan-1-one CAS Name: 6-methyl-1-[2-(4-pentyl-2-pyridinyl)phenyl]-1-octanone IUPAC Name: 6-methyl-1-[2-(4-pentylpyridin-2-yl)phenyl]octan-1-one Traditional Name: 1-[2-(4-amyl-2-pyridyl)phenyl]-6-methyl-octan-1-one Formula: C25H35NO MolecularWeight: 365.5515

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=NC=C1)C2=CC=CC=C2C(=O)CCCCC(C)CC

Isomeric SMILES

CCCCCC1=CC(=NC=C1)C2=CC=CC=C2C(=O)CCCCC(C)CC

InChI

InChI=1S/C25H35NO/c1-4-6-7-13-21-17-18-26-24(19-21)22-14-9-10-15-23(22)25(27)16-11-8-12-20(3)5-2/h9-10,14-15,17-20H,4-8,11-13,16H2,1-3H3