5-ethyl-2-(2-hydroxyethyl)-4-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1,2,4-triazol-3-one

Systemtic Name: 5-ethyl-2-(2-hydroxyethyl)-4-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1,2,4-triazol-3-one Openeye Name: 5-ethyl-2-(2-hydroxyethyl)-4-[(E)-(5-nitro-2-furyl)methyleneamino]-1,2,4-triazol-3-one CAS Name: 5-ethyl-2-(2-hydroxyethyl)-4-[(E)-(5-nitro-2-furanyl)methylideneamino]-1,2,4-triazol-3-one IUPAC Name: 5-ethyl-2-(2-hydroxyethyl)-4-[(E)-(5-nitrofuran-2-yl)methylideneamino]-1,2,4-triazol-3-one Traditional Name: 5-ethyl-2-(2-hydroxyethyl)-4-[(E)-(5-nitro-2-furyl)methyleneamino]-1,2,4-triazol-3-one Formula: C11H13N5O5 MolecularWeight: 295.25142

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)N1N=CC2=CC=C(O2)[N+](=O)[O-])CCO

Isomeric SMILES

CCC1=NN(C(=O)N1/N=C/C2=CC=C(O2)[N+](=O)[O-])CCO

InChI

InChI=1S/C11H13N5O5/c1-2-9-13-14(5-6-17)11(18)15(9)12-7-8-3-4-10(21-8)16(19)20/h3-4,7,17H,2,5-6H2,1H3/b12-7+