propan-2-yl 2-(3-nitro-1,2,4-triazol-1-yl)ethanoate

Systemtic Name: propan-2-yl 2-(3-nitro-1,2,4-triazol-1-yl)ethanoate Openeye Name: isopropyl 2-(3-nitro-1,2,4-triazol-1-yl)acetate CAS Name: 2-(3-nitro-1,2,4-triazol-1-yl)acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-(3-nitro-1,2,4-triazol-1-yl)acetate Traditional Name: 2-(3-nitro-1,2,4-triazol-1-yl)acetic acid isopropyl ester Formula: C7H10N4O4 MolecularWeight: 214.1787

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CN1C=NC(=N1)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)CN1C=NC(=N1)[N+](=O)[O-]

InChI

InChI=1S/C7H10N4O4/c1-5(2)15-6(12)3-10-4-8-7(9-10)11(13)14/h4-5H,3H2,1-2H3