1,3-dibutyl-1-[(E)-(5-nitrofuran-2-yl)methylideneamino]urea

Systemtic Name: 1,3-dibutyl-1-[(E)-(5-nitrofuran-2-yl)methylideneamino]urea Openeye Name: 1,3-dibutyl-1-[(E)-(5-nitro-2-furyl)methyleneamino]urea CAS Name: 1,3-dibutyl-1-[(E)-(5-nitro-2-furanyl)methylideneamino]urea IUPAC Name: 1,3-dibutyl-1-[(E)-(5-nitrofuran-2-yl)methylideneamino]urea Traditional Name: 1,3-dibutyl-1-[(E)-(5-nitro-2-furyl)methyleneamino]urea Formula: C14H22N4O4 MolecularWeight: 310.34888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N4O4/c1-3-5-9-15-14(19)17(10-6-4-2)16-11-12-7-8-13(22-12)18(20)21/h7-8,11H,3-6,9-10H2,1-2H3,(H,15,19)/b16-11+