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

Systemtic Name: 1-butyl-3-[(E)-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]amino]urea Openeye Name: 1-butyl-3-[(E)-[(E)-3-(5-nitro-2-furyl)prop-2-enylidene]amino]urea CAS Name: 1-butyl-3-[(E)-[(E)-3-(5-nitro-2-furanyl)prop-2-enylidene]amino]urea IUPAC Name: 1-butyl-3-[(E)-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]amino]urea Traditional Name: 1-butyl-3-[(E)-[(E)-3-(5-nitro-2-furyl)prop-2-enylidene]amino]urea Formula: C12H16N4O4 MolecularWeight: 280.27984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N4O4/c1-2-3-8-13-12(17)15-14-9-4-5-10-6-7-11(20-10)16(18)19/h4-7,9H,2-3,8H2,1H3,(H2,13,15,17)/b5-4+,14-9+