[(E)-[1-methyl-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylideneamino] butanoate

Systemtic Name: [(E)-[1-methyl-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylideneamino] butanoate Openeye Name: [(E)-[1-methyl-3-(5-nitro-2-furyl)pyrazol-4-yl]methyleneamino] butanoate CAS Name: butanoic acid [(E)-[1-methyl-3-(5-nitro-2-furanyl)-4-pyrazolyl]methylideneamino] ester IUPAC Name: [(E)-[1-methyl-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylideneamino] butanoate Traditional Name: butyric acid [(E)-[1-methyl-3-(5-nitro-2-furyl)pyrazol-4-yl]methyleneamino] ester Formula: C13H14N4O5 MolecularWeight: 306.27406

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)ON=CC1=CN(N=C1C2=CC=C(O2)[N+](=O)[O-])C

Isomeric SMILES

CCCC(=O)O/N=C/C1=CN(N=C1C2=CC=C(O2)[N+](=O)[O-])C

InChI

InChI=1S/C13H14N4O5/c1-3-4-12(18)22-14-7-9-8-16(2)15-13(9)10-5-6-11(21-10)17(19)20/h5-8H,3-4H2,1-2H3/b14-7+