N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-2-pyrrolidin-1-ium-1-yl-ethanamide chloride

Systemtic Name: N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-2-pyrrolidin-1-ium-1-yl-ethanamide chloride Openeye Name: N-[(E)-(5-nitro-2-furyl)methyleneamino]-2-pyrrolidin-1-ium-1-yl-acetamide chloride CAS Name: N-[(E)-(5-nitro-2-furanyl)methylideneamino]-2-(1-pyrrolidin-1-iumyl)acetamide chloride IUPAC Name: N-[(E)-(5-nitrofuran-2-yl)methylideneamino]-2-pyrrolidin-1-ium-1-ylacetamide chloride Traditional Name: N-[(E)-(5-nitro-2-furyl)methyleneamino]-2-pyrrolidin-1-ium-1-yl-acetamide chloride Formula: C11H15ClN4O4 MolecularWeight: 302.7142

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)NN=CC2=CC=C(O2)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1CC[NH+](C1)CC(=O)N/N=C/C2=CC=C(O2)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C11H14N4O4.ClH/c16-10(8-14-5-1-2-6-14)13-12-7-9-3-4-11(19-9)15(17)18;/h3-4,7H,1-2,5-6,8H2,(H,13,16);1H/b12-7+;