3-[[(2-oxidanylideneazepan-3-yl)amino]methylidene]pentane-2,4-dione

Systemtic Name: 3-[[(2-oxidanylideneazepan-3-yl)amino]methylidene]pentane-2,4-dione Openeye Name: 3-[[(2-oxoazepan-3-yl)amino]methylene]pentane-2,4-dione CAS Name: 3-[[(2-oxo-3-azepanyl)amino]methylidene]pentane-2,4-dione IUPAC Name: 3-[[(2-oxoazepan-3-yl)amino]methylidene]pentane-2,4-dione Traditional Name: 3-[[(2-ketoazepan-3-yl)amino]methylene]pentane-2,4-dione Formula: C12H18N2O3 MolecularWeight: 238.28292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CNC1CCCCNC1=O)C(=O)C

Isomeric SMILES

CC(=O)C(=CNC1CCCCNC1=O)C(=O)C

InChI

InChI=1S/C12H18N2O3/c1-8(15)10(9(2)16)7-14-11-5-3-4-6-13-12(11)17/h7,11,14H,3-6H2,1-2H3,(H,13,17)