trimethyl-[4-oxidanylidene-2-propanoyloxy-4-[(3,5,6-trimethylpyrazin-2-yl)methoxy]butyl]azanium chloride

Systemtic Name: trimethyl-[4-oxidanylidene-2-propanoyloxy-4-[(3,5,6-trimethylpyrazin-2-yl)methoxy]butyl]azanium chloride Openeye Name: trimethyl-[4-oxo-2-propanoyloxy-4-[(3,5,6-trimethylpyrazin-2-yl)methoxy]butyl]ammonium chloride CAS Name: trimethyl-[4-oxo-2-(1-oxopropoxy)-4-[(3,5,6-trimethyl-2-pyrazinyl)methoxy]butyl]ammonium chloride IUPAC Name: trimethyl-[4-oxo-2-propanoyloxy-4-[(3,5,6-trimethylpyrazin-2-yl)methoxy]butyl]azanium chloride Traditional Name: [4-keto-2-propionyloxy-4-[(3,5,6-trimethylpyrazin-2-yl)methoxy]butyl]-trimethyl-ammonium chloride Formula: C18H30ClN3O4 MolecularWeight: 387.9015

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(CC(=O)OCC1=NC(=C(N=C1C)C)C)C[N+](C)(C)C.[Cl-]

Isomeric SMILES

CCC(=O)OC(CC(=O)OCC1=NC(=C(N=C1C)C)C)C[N+](C)(C)C.[Cl-]

InChI

InChI=1S/C18H30N3O4.ClH/c1-8-17(22)25-15(10-21(5,6)7)9-18(23)24-11-16-14(4)19-12(2)13(3)20-16;/h15H,8-11H2,1-7H3;1H/q+1;/p-1