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

Systemtic Name: 2-(1-cyano-4-methyl-5-oxidanylidene-4-propan-2-yl-imidazol-2-yl)-5-(methoxymethyl)pyridine-3-carboxylate; tetrabutylazanium Openeye Name: 2-(1-cyano-4-isopropyl-4-methyl-5-oxo-imidazol-2-yl)-5-(methoxymethyl)pyridine-3-carboxylate; tetrabutylammonium CAS Name: 2-(1-cyano-4-methyl-5-oxo-4-propan-2-yl-2-imidazolyl)-5-(methoxymethyl)-3-pyridinecarboxylate; tetrabutylammonium IUPAC Name: 2-(1-cyano-4-methyl-5-oxo-4-propan-2-ylimidazol-2-yl)-5-(methoxymethyl)pyridine-3-carboxylate; tetrabutylazanium Traditional Name: 2-(1-cyano-4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-5-(methoxymethyl)nicotinate; tetrabutylammonium Formula: C32H53N5O4 MolecularWeight: 571.79432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCCC)CCCC.CC(C)C1(C(=O)N(C(=N1)C2=NC=C(C=C2C(=O)[O-])COC)C#N)C

Isomeric SMILES

CCCC[N+](CCCC)(CCCC)CCCC.CC(C)C1(C(=O)N(C(=N1)C2=NC=C(C=C2C(=O)[O-])COC)C#N)C

InChI

InChI=1S/C16H18N4O4.C16H36N/c1-9(2)16(3)15(23)20(8-17)13(19-16)12-11(14(21)22)5-10(6-18-12)7-24-4;1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h5-6,9H,7H2,1-4H3,(H,21,22);5-16H2,1-4H3/q;+1/p-1