3-[(2-methylpyrazol-3-yl)methylamino]azepan-2-one

Systemtic Name: 3-[(2-methylpyrazol-3-yl)methylamino]azepan-2-one Openeye Name: 3-[(2-methylpyrazol-3-yl)methylamino]azepan-2-one CAS Name: 3-[(2-methyl-3-pyrazolyl)methylamino]-2-azepanone IUPAC Name: 3-[(2-methylpyrazol-3-yl)methylamino]azepan-2-one Traditional Name: 3-[(2-methylpyrazol-3-yl)methylamino]azepan-2-one Formula: C11H18N4O MolecularWeight: 222.28682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)CNC2CCCCNC2=O

Isomeric SMILES

CN1C(=CC=N1)CNC2CCCCNC2=O

InChI

InChI=1S/C11H18N4O/c1-15-9(5-7-14-15)8-13-10-4-2-3-6-12-11(10)16/h5,7,10,13H,2-4,6,8H2,1H3,(H,12,16)