2-(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)-N-[(2S)-6-methylheptan-2-yl]ethanamide

Systemtic Name: 2-(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)-N-[(2S)-6-methylheptan-2-yl]ethanamide Openeye Name: 2-(3-cyano-5-nitro-2-oxo-1-pyridyl)-N-[(1S)-1,5-dimethylhexyl]acetamide CAS Name: 2-(3-cyano-5-nitro-2-oxo-1-pyridinyl)-N-[(2S)-6-methylheptan-2-yl]acetamide IUPAC Name: 2-(3-cyano-5-nitro-2-oxopyridin-1-yl)-N-[(2S)-6-methylheptan-2-yl]acetamide Traditional Name: 2-(3-cyano-2-keto-5-nitro-1-pyridyl)-N-[(1S)-1,5-dimethylhexyl]acetamide Formula: C16H22N4O4 MolecularWeight: 334.37028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)CN1C=C(C=C(C1=O)C#N)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](CCCC(C)C)NC(=O)CN1C=C(C=C(C1=O)C#N)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O4/c1-11(2)5-4-6-12(3)18-15(21)10-19-9-14(20(23)24)7-13(8-17)16(19)22/h7,9,11-12H,4-6,10H2,1-3H3,(H,18,21)/t12-/m0/s1