2-[2-[dimethylamino(propyl)amino]-2-oxidanylidene-ethyl]-5-nitro-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 2-[2-[dimethylamino(propyl)amino]-2-oxidanylidene-ethyl]-5-nitro-1,2,4-triazole-3-carboxylic acid Openeye Name: 2-[2-[dimethylamino(propyl)amino]-2-oxo-ethyl]-5-nitro-1,2,4-triazole-3-carboxylic acid CAS Name: 2-[2-[dimethylamino(propyl)amino]-2-oxoethyl]-5-nitro-1,2,4-triazole-3-carboxylic acid IUPAC Name: 2-[2-[dimethylamino(propyl)amino]-2-oxoethyl]-5-nitro-1,2,4-triazole-3-carboxylic acid Traditional Name: 2-[2-[dimethylamino(propyl)amino]-2-keto-ethyl]-5-nitro-1,2,4-triazole-3-carboxylic acid Formula: C10H16N6O5 MolecularWeight: 300.27124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H16N6O5/c1-4-5-15(13(2)3)7(17)6-14-8(9(18)19)11-10(12-14)16(20)21/h4-6H2,1-3H3,(H,18,19)