1-hexyl-3-[(E)-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]amino]urea

Systemtic Name: 1-hexyl-3-[(E)-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]amino]urea Openeye Name: 1-hexyl-3-[(E)-[(E)-3-(5-nitro-2-furyl)prop-2-enylidene]amino]urea CAS Name: 1-hexyl-3-[(E)-[(E)-3-(5-nitro-2-furanyl)prop-2-enylidene]amino]urea IUPAC Name: 1-hexyl-3-[(E)-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]amino]urea Traditional Name: 1-hexyl-3-[(E)-[(E)-3-(5-nitro-2-furyl)prop-2-enylidene]amino]urea Formula: C14H20N4O4 MolecularWeight: 308.333

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)NN=CC=CC1=CC=C(O1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCNC(=O)N/N=C/C=C/C1=CC=C(O1)[N+](=O)[O-]

InChI

InChI=1S/C14H20N4O4/c1-2-3-4-5-10-15-14(19)17-16-11-6-7-12-8-9-13(22-12)18(20)21/h6-9,11H,2-5,10H2,1H3,(H2,15,17,19)/b7-6+,16-11+