4,4-dimethyl-1-phenyl-1-pyridin-4-yl-pentan-3-one

Systemtic Name: 4,4-dimethyl-1-phenyl-1-pyridin-4-yl-pentan-3-one Openeye Name: 4,4-dimethyl-1-phenyl-1-(4-pyridyl)pentan-3-one CAS Name: 4,4-dimethyl-1-phenyl-1-pyridin-4-yl-3-pentanone IUPAC Name: 4,4-dimethyl-1-phenyl-1-pyridin-4-ylpentan-3-one Traditional Name: 4,4-dimethyl-1-phenyl-1-(4-pyridyl)pentan-3-one Formula: C18H21NO MolecularWeight: 267.36544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CC(C1=CC=CC=C1)C2=CC=NC=C2

Isomeric SMILES

CC(C)(C)C(=O)CC(C1=CC=CC=C1)C2=CC=NC=C2

InChI

InChI=1S/C18H21NO/c1-18(2,3)17(20)13-16(14-7-5-4-6-8-14)15-9-11-19-12-10-15/h4-12,16H,13H2,1-3H3