5-methyl-4-(2-pyridin-4-ylethyl)pyrazol-3-one

Systemtic Name: 5-methyl-4-(2-pyridin-4-ylethyl)pyrazol-3-one Openeye Name: 5-methyl-4-[2-(4-pyridyl)ethyl]pyrazol-3-one CAS Name: 5-methyl-4-(2-pyridin-4-ylethyl)-3-pyrazolone IUPAC Name: 5-methyl-4-(2-pyridin-4-ylethyl)pyrazol-3-one Traditional Name: 5-methyl-4-[2-(4-pyridyl)ethyl]pyrazol-3-one Formula: C11H11N3O MolecularWeight: 201.22454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=N1)CCC2=CC=NC=C2

Isomeric SMILES

CC1=C(C(=O)N=N1)CCC2=CC=NC=C2

InChI

InChI=1S/C11H11N3O/c1-8-10(11(15)14-13-8)3-2-9-4-6-12-7-5-9/h4-7H,2-3H2,1H3