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

Systemtic Name: methyl N-[(E)-[3-(5-nitrofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]carbamate Openeye Name: methyl N-[(E)-[3-(5-nitro-2-furyl)-1-phenyl-pyrazol-4-yl]methyleneamino]carbamate CAS Name: N-[(E)-[3-(5-nitro-2-furanyl)-1-phenyl-4-pyrazolyl]methylideneamino]carbamic acid methyl ester IUPAC Name: methyl N-[(E)-[3-(5-nitrofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]carbamate Traditional Name: N-[(E)-[3-(5-nitro-2-furyl)-1-phenyl-pyrazol-4-yl]methyleneamino]carbamic acid methyl ester Formula: C16H13N5O5 MolecularWeight: 355.30492

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NN=CC1=CN(N=C1C2=CC=C(O2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

COC(=O)N/N=C/C1=CN(N=C1C2=CC=C(O2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C16H13N5O5/c1-25-16(22)18-17-9-11-10-20(12-5-3-2-4-6-12)19-15(11)13-7-8-14(26-13)21(23)24/h2-10H,1H3,(H,18,22)/b17-9+