ethyl 2-(1-methyl-1,2,4-triazol-4-ium-4-yl)ethanoate chloride

Systemtic Name: ethyl 2-(1-methyl-1,2,4-triazol-4-ium-4-yl)ethanoate chloride Openeye Name: ethyl 2-(1-methyl-1,2,4-triazol-4-ium-4-yl)acetate chloride CAS Name: 2-(1-methyl-1,2,4-triazol-4-ium-4-yl)acetic acid ethyl ester chloride IUPAC Name: ethyl 2-(1-methyl-1,2,4-triazol-4-ium-4-yl)acetate chloride Traditional Name: 2-(1-methyl-1,2,4-triazol-4-ium-4-yl)acetic acid ethyl ester chloride Formula: C7H12ClN3O2 MolecularWeight: 205.64208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=CN(N=C1)C.[Cl-]

Isomeric SMILES

CCOC(=O)C[N+]1=CN(N=C1)C.[Cl-]

InChI

InChI=1S/C7H12N3O2.ClH/c1-3-12-7(11)4-10-5-8-9(2)6-10;/h5-6H,3-4H2,1-2H3;1H/q+1;/p-1