1-[(E)-[1-(5-nitrofuran-2-yl)-3-piperidin-1-yl-propylidene]amino]urea chloride

Systemtic Name: 1-[(E)-[1-(5-nitrofuran-2-yl)-3-piperidin-1-yl-propylidene]amino]urea chloride Openeye Name: [(E)-[1-(5-nitro-2-furyl)-3-(1-piperidyl)propylidene]amino]urea chloride CAS Name: [(E)-[1-(5-nitro-2-furanyl)-3-(1-piperidinyl)propylidene]amino]urea chloride IUPAC Name: [(E)-[1-(5-nitrofuran-2-yl)-3-piperidin-1-ylpropylidene]amino]urea chloride Traditional Name: [(E)-[1-(5-nitro-2-furyl)-3-piperidino-propylidene]amino]urea chloride Formula: C13H19ClN5O4- MolecularWeight: 344.77406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC(=NNC(=O)N)C2=CC=C(O2)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1CCN(CC1)CC/C(=N\NC(=O)N)/C2=CC=C(O2)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C13H19N5O4.ClH/c14-13(19)16-15-10(6-9-17-7-2-1-3-8-17)11-4-5-12(22-11)18(20)21;/h4-5H,1-3,6-9H2,(H3,14,16,19);1H/p-1/b15-10+;