2-(1-cyano-4-methyl-5-oxidanylidene-4-propan-2-yl-imidazol-2-yl)-5-ethyl-pyridine-3-carboxylate; tetrabutylazanium

Systemtic Name: 2-(1-cyano-4-methyl-5-oxidanylidene-4-propan-2-yl-imidazol-2-yl)-5-ethyl-pyridine-3-carboxylate; tetrabutylazanium Openeye Name: 2-(1-cyano-4-isopropyl-4-methyl-5-oxo-imidazol-2-yl)-5-ethyl-pyridine-3-carboxylate; tetrabutylammonium CAS Name: 2-(1-cyano-4-methyl-5-oxo-4-propan-2-yl-2-imidazolyl)-5-ethyl-3-pyridinecarboxylate; tetrabutylammonium IUPAC Name: 2-(1-cyano-4-methyl-5-oxo-4-propan-2-ylimidazol-2-yl)-5-ethylpyridine-3-carboxylate; tetrabutylazanium Traditional Name: 2-(1-cyano-4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-5-ethyl-nicotinate; tetrabutylammonium Formula: C32H53N5O3 MolecularWeight: 555.79492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.CCC1=CN=C(C(=C1)C(=O)[O-])C2=NC(C(=O)N2C#N)(C)C(C)C

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.CCC1=CN=C(C(=C1)C(=O)[O-])C2=NC(C(=O)N2C#N)(C)C(C)C

InChI

InChI=1S/C16H18N4O3.C16H36N/c1-5-10-6-11(14(21)22)12(18-7-10)13-19-16(4,9(2)3)15(23)20(13)8-17;1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h6-7,9H,5H2,1-4H3,(H,21,22);5-16H2,1-4H3/q;+1/p-1