[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 5-nitrofuran-2-carboxylate

Systemtic Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 5-nitrofuran-2-carboxylate Openeye Name: [2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl] 5-nitrofuran-2-carboxylate CAS Name: 5-nitro-2-furancarboxylic acid [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] 5-nitrofuran-2-carboxylate Traditional Name: 5-nitrofuran-2-carboxylic acid [2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl] ester Formula: C14H16N2O6 MolecularWeight: 308.28664

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)COC(=O)C1=CC=C(O1)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)(C#C)NC(=O)COC(=O)C1=CC=C(O1)[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O6/c1-4-14(5-2,6-3)15-11(17)9-21-13(18)10-7-8-12(22-10)16(19)20/h1,7-8H,5-6,9H2,2-3H3,(H,15,17)