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

Systemtic Name: trimethyl-[4-oxidanylidene-2-pentanoyloxy-4-[(3,5,6-trimethylpyrazin-2-yl)methoxy]butyl]azanium chloride Openeye Name: trimethyl-[4-oxo-2-pentanoyloxy-4-[(3,5,6-trimethylpyrazin-2-yl)methoxy]butyl]ammonium chloride CAS Name: trimethyl-[4-oxo-2-(1-oxopentoxy)-4-[(3,5,6-trimethyl-2-pyrazinyl)methoxy]butyl]ammonium chloride IUPAC Name: trimethyl-[4-oxo-2-pentanoyloxy-4-[(3,5,6-trimethylpyrazin-2-yl)methoxy]butyl]azanium chloride Traditional Name: [4-keto-4-[(3,5,6-trimethylpyrazin-2-yl)methoxy]-2-valeryloxy-butyl]-trimethyl-ammonium chloride Formula: C20H34ClN3O4 MolecularWeight: 415.95466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H34N3O4.ClH/c1-8-9-10-19(24)27-17(12-23(5,6)7)11-20(25)26-13-18-16(4)21-14(2)15(3)22-18;/h17H,8-13H2,1-7H3;1H/q+1;/p-1