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

Systemtic Name: 1-[2-(4-heptylpyridin-2-yl)phenyl]-6-methyl-octan-1-one Openeye Name: 1-[2-(4-heptyl-2-pyridyl)phenyl]-6-methyl-octan-1-one CAS Name: 1-[2-(4-heptyl-2-pyridinyl)phenyl]-6-methyl-1-octanone IUPAC Name: 1-[2-(4-heptylpyridin-2-yl)phenyl]-6-methyloctan-1-one Traditional Name: 1-[2-(4-heptyl-2-pyridyl)phenyl]-6-methyl-octan-1-one Formula: C27H39NO MolecularWeight: 393.60466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=NC=C1)C2=CC=CC=C2C(=O)CCCCC(C)CC

Isomeric SMILES

CCCCCCCC1=CC(=NC=C1)C2=CC=CC=C2C(=O)CCCCC(C)CC

InChI

InChI=1S/C27H39NO/c1-4-6-7-8-9-15-23-19-20-28-26(21-23)24-16-11-12-17-25(24)27(29)18-13-10-14-22(3)5-2/h11-12,16-17,19-22H,4-10,13-15,18H2,1-3H3