heptyl N-[(E)-(5-nitrofuran-2-yl)methylideneamino]carbamate

Systemtic Name: heptyl N-[(E)-(5-nitrofuran-2-yl)methylideneamino]carbamate Openeye Name: heptyl N-[(E)-(5-nitro-2-furyl)methyleneamino]carbamate CAS Name: N-[(E)-(5-nitro-2-furanyl)methylideneamino]carbamic acid heptyl ester IUPAC Name: heptyl N-[(E)-(5-nitrofuran-2-yl)methylideneamino]carbamate Traditional Name: N-[(E)-(5-nitro-2-furyl)methyleneamino]carbamic acid heptyl ester Formula: C13H19N3O5 MolecularWeight: 297.30706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O5/c1-2-3-4-5-6-9-20-13(17)15-14-10-11-7-8-12(21-11)16(18)19/h7-8,10H,2-6,9H2,1H3,(H,15,17)/b14-10+