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

Systemtic Name: 1-[(E)-[2-(5-nitrofuran-2-yl)-3-piperidin-1-yl-propylidene]amino]urea hydrochloride Openeye Name: [(E)-[2-(5-nitro-2-furyl)-3-(1-piperidyl)propylidene]amino]urea hydrochloride CAS Name: [(E)-[2-(5-nitro-2-furanyl)-3-(1-piperidinyl)propylidene]amino]urea hydrochloride IUPAC Name: [(E)-[2-(5-nitrofuran-2-yl)-3-piperidin-1-ylpropylidene]amino]urea hydrochloride Traditional Name: [(E)-[2-(5-nitro-2-furyl)-3-piperidino-propylidene]amino]urea hydrochloride Formula: C13H20ClN5O4 MolecularWeight: 345.782

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(C=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)16-15-8-10(9-17-6-2-1-3-7-17)11-4-5-12(22-11)18(20)21;/h4-5,8,10H,1-3,6-7,9H2,(H3,14,16,19);1H/b15-8+;