2-acetamidoethyl chloromethyl carbonate; 1H-1,2,4-triazol-1-ium

Systemtic Name: 2-acetamidoethyl chloromethyl carbonate; 1H-1,2,4-triazol-1-ium Openeye Name: 2-acetamidoethyl chloromethyl carbonate; 1H-1,2,4-triazol-1-ium CAS Name: carbonic acid 2-acetamidoethyl chloromethyl ester; 1H-1,2,4-triazol-1-ium IUPAC Name: 2-acetamidoethyl chloromethyl carbonate; 1H-1,2,4-triazol-1-ium Traditional Name: carbonic acid 2-acetamidoethyl chloromethyl ester; 1H-1,2,4-triazol-1-ium Formula: C8H14ClN4O4+ MolecularWeight: 265.67416

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCOC(=O)OCCl.C1=NC=N[NH2+]1

Isomeric SMILES

CC(=O)NCCOC(=O)OCCl.C1=NC=N[NH2+]1

InChI

InChI=1S/C6H10ClNO4.C2H3N3/c1-5(9)8-2-3-11-6(10)12-4-7;1-3-2-5-4-1/h2-4H2,1H3,(H,8,9);1-2H,(H,3,4,5)/p+1